Meosiuuubeo/act_length28 · Datasets at Hugging Face

cmpdname stringlengths 28 28	mf stringlengths 2 25
Magnesium;2-hydroxybutanoate	C8H14MgO6
PC(20:4(5Z,8Z,11Z,14Z)/15:0)	C43H78NO8P
Dibenzyl-bis(ethenyl)azanium	C18H20N+
Benzo[e]indole-3-carboxylate	C13H8NO2-
2-cyano-N,N-dihexylacetamide	C15H28N2O
Benzo-1,3,2-dioxaphosphepine	C8H7O2P
Formic acid;pentane-1,5-diol	C6H14O4
1,1-Difluorododec-3-yn-2-one	C12H18F2O
4-Ethyl-5-methyl-1,3-dioxane	C7H14O2
3-Bromo-4-pyridin-2-ylphenol	C11H8BrNO
2,6,11-Trimethyltriphenylene	C21H18
Tri(o-ethylphenyl) phosphite	C24H27O3P
3-(furan-2-yl)-2H-oxadiazole	C6H6N2O2
H-Ser-Trp-Leu-Arg-Pro-Cys-OH	C34H52N10O8S
3-methyl-6-nitro-9H-fluorene	C14H11NO2
4,7-dimethyl-1H-indazol-5-ol	C9H10N2O
2-Vinyloxy-ethyl thiocyanate	C5H7NOS
Tris(trimethylsiloxy)ferrane	C14H40FeO3Si3
(E,2S)-4-propyloct-3-en-2-ol	C11H22O
H-Phe-Thr-Phe-Asp-Pro-Phe-OH	C40H48N6O10
2-Naphthol, 1-ethyl-6-hexyl-	C18H24O
Distearoyl phosphatidic acid	C39H77O8P
p-Ethoxyphenylmethacrylamide	C12H15NO2
2-Butyl-4-methyl-1,3-dioxane	C9H18O2
PG(18:1(9Z)/18:3(6Z,9Z,12Z))	C42H75O10P
2-Methylspiro[2.5]octan-2-ol	C9H16O
Dimethyl-sulfoniumpropionate	C5H10O2S
1-(Oxan-4-yl)hexadecan-1-one	C21H40O2
Butyl-ethenyl-dimethylsilane	C8H18Si
Heptacosa-22,25-dienoic acid	C27H50O2
2,5-Dimethylhexanedioic acid	C8H14O4
2-Quinazolin-7-ylacetic acid	C10H8N2O2
2-(2-nitrophenoxy)Ethanamine	C8H10N2O3
(Pentafluorophenyl)porphyrin	C26H13F5N4
N-(4-butylphenyl)propanamide	C13H19NO
3-(2-Methoxyethyl)oxan-4-one	C8H14O3
Acetic acid;scandium;hydrate	C6H14O7Sc
oxiren-2-yl (E)-but-2-enoate	C6H6O3
ZINC chlorin carboxylic acid	CHClO2Zn
2,5-Dimethylhex-4-en-2-amine	C8H17N
9-tert-butyl-9H-xanthen-4-ol	C17H18O2
1-Hydrazinylpropane-1,2-diol	C3H10N2O2
2,6-Dioxoheptan-4-yl acetate	C9H14O4
N-succinyl-(s)-phenylglycine	C18H15NO4
2,3-Dimethyl-4-propoxyphenol	C11H16O2
1H-pyrimidin-2-one;dihydrate	C4H8N2O3
2-Acetoxy-1,5-dibromopentane	C7H12Br2O2
(E)-N-phenyloct-3-en-1-imine	C14H19N
1-Octynyl succinic anhydride	C12H16O3
5-Tert-butylindene-1,3-dione	C13H14O2
1-Methylbicyclo[4.3.1]decane	C11H20
2-Cyclododecylethoxymethanol	C15H30O2
Sodium;benzene;butanoic acid	C10H13NaO2
Butanediamide, N,N'-dihexyl-	C16H32N2O2
N4-ethylpyridine-3,4-diamine	C7H11N3
6-Bromo-5-chloroisoquinoline	C9H5BrClN
(2-Propoxyethoxy)acetic acid	C7H14O4
4a,16b-Dihydrotetraphenylene	C24H18
2,4-Difluoro-3-propoxyphenol	C9H10F2O2
PA(22:0/18:4(6Z,9Z,12Z,15Z))	C43H77O8P
N-benzhydrylundec-10-enamide	C24H31NO
3-Nitroheptadecanedioic acid	C17H31NO6
Aminomethylene diphosphonate	CH3NO5P2+2
m-Xylylene-bis-diglycolamide	C16H22N4O6
(3S)-3-methylpiperidin-1-ium	C6H14N+
PG(16:0/18:2(9Z,11E)+=O(13))	C40H73O11P
Dibutyl(phenylmethoxy)silane	C15H26OSi
Oxirane-2-carboxamide;phenol	C9H11NO3
Alumanylmethyl(ethoxy)silane	C3H11AlOSi
N,N-Dicarbamoyldecanediamide	C12H22N4O4
US11613532, Example A6-1-1-2	C23H35F3N6O2
2-Methyl-5-phenylselenophene	C11H10Se
2,2-Dibromoheptanedioic acid	C7H10Br2O4
Ethyl 2-benzoylhept-5-ynoate	C16H18O3
Benzyl(carboxymethyl)azanide	C9H10NO2-
3,5-Diethyl-1-benzothiophene	C12H14S
N-acetyl-N-adamantoylaniline	C19H23NO2
5-Quinolin-8-yliminopentanal	C14H14N2O
1-Hydroxy-1,5-benzodiazepine	C9H8N2O
HOCOCH2-D-Cys-D-Cys-D-Val-OH	C13H23N3O6S2
(8Z,13Z,18R,20Z)-strobilinin	C25H34O4
4-(Propylthio)-1,1'-biphenyl	C15H16S
3-Iodo-7-methyl-1-benzofuran	C9H7IO
H-Gly-Ala-Ala-Leu-Cys-Leu-OH	C23H42N6O7S
1-Chloro-4-methylcyclodecane	C11H21Cl
US10550102, Example 40-3 (+)	C38H44N4O4
H-Gly-Cys-Lys-Gly-Cys-Gly-OH	C18H33N7O7S2
7-(Dihexylamino)dodecan-1-ol	C24H51NO
1,8-Bis(2-ethylhexoxy)octane	C24H50O2
2,4-Dimethyloxan-3-ol;ethane	C11H26O2
Tos-Sar-N(Bn(4-Br))Ala-NHtBu	C24H32BrN3O4S
Oxacyclohexadecane-2,6-dione	C15H26O3
3-Octyloxyphenylboronic acid	C14H23BO3
Naphthalene-1,4-diol;yttrium	C10H8O2Y2
Methanol;titanium;dichloride	C4H16Cl2O4Ti-2
Ammonium a-hydroxy-o-toluate	C8H11NO3
Ethane;pent-2-yne;1,4-xylene	C15H24
2-(5-Iodothiophen-2-yl)furan	C8H5IOS
2,2,5-Trimethylhexyl formate	C10H20O2
9-Sulfotetracene-2-sulfinate	C18H11O5S2-

Magnesium;2-hydroxybutanoate

C8H14MgO6

PC(20:4(5Z,8Z,11Z,14Z)/15:0)

C43H78NO8P

Dibenzyl-bis(ethenyl)azanium

C18H20N+

Benzo[e]indole-3-carboxylate

C13H8NO2-

2-cyano-N,N-dihexylacetamide

C15H28N2O

Benzo-1,3,2-dioxaphosphepine

C8H7O2P

Formic acid;pentane-1,5-diol

C6H14O4

1,1-Difluorododec-3-yn-2-one

C12H18F2O

4-Ethyl-5-methyl-1,3-dioxane

C7H14O2

3-Bromo-4-pyridin-2-ylphenol

C11H8BrNO

2,6,11-Trimethyltriphenylene

C21H18

Tri(o-ethylphenyl) phosphite

C24H27O3P

3-(furan-2-yl)-2H-oxadiazole

C6H6N2O2

H-Ser-Trp-Leu-Arg-Pro-Cys-OH

C34H52N10O8S

3-methyl-6-nitro-9H-fluorene

C14H11NO2

4,7-dimethyl-1H-indazol-5-ol

C9H10N2O

2-Vinyloxy-ethyl thiocyanate

C5H7NOS

Tris(trimethylsiloxy)ferrane

C14H40FeO3Si3

(E,2S)-4-propyloct-3-en-2-ol

C11H22O

H-Phe-Thr-Phe-Asp-Pro-Phe-OH

C40H48N6O10

2-Naphthol, 1-ethyl-6-hexyl-

C18H24O

Distearoyl phosphatidic acid

C39H77O8P

p-Ethoxyphenylmethacrylamide

C12H15NO2

2-Butyl-4-methyl-1,3-dioxane

C9H18O2

PG(18:1(9Z)/18:3(6Z,9Z,12Z))

C42H75O10P

2-Methylspiro[2.5]octan-2-ol

C9H16O

Dimethyl-sulfoniumpropionate

C5H10O2S

1-(Oxan-4-yl)hexadecan-1-one

C21H40O2

Butyl-ethenyl-dimethylsilane

C8H18Si

Heptacosa-22,25-dienoic acid

C27H50O2

2,5-Dimethylhexanedioic acid

C8H14O4

2-Quinazolin-7-ylacetic acid

C10H8N2O2

2-(2-nitrophenoxy)Ethanamine

C8H10N2O3

(Pentafluorophenyl)porphyrin

C26H13F5N4

N-(4-butylphenyl)propanamide

C13H19NO

3-(2-Methoxyethyl)oxan-4-one

C8H14O3

Acetic acid;scandium;hydrate

C6H14O7Sc

oxiren-2-yl (E)-but-2-enoate

C6H6O3

ZINC chlorin carboxylic acid

CHClO2Zn

2,5-Dimethylhex-4-en-2-amine

C8H17N

9-tert-butyl-9H-xanthen-4-ol

C17H18O2

1-Hydrazinylpropane-1,2-diol

C3H10N2O2

2,6-Dioxoheptan-4-yl acetate

C9H14O4

N-succinyl-(s)-phenylglycine

C18H15NO4

2,3-Dimethyl-4-propoxyphenol

C11H16O2

1H-pyrimidin-2-one;dihydrate

C4H8N2O3

2-Acetoxy-1,5-dibromopentane

C7H12Br2O2

(E)-N-phenyloct-3-en-1-imine

C14H19N

1-Octynyl succinic anhydride

C12H16O3

5-Tert-butylindene-1,3-dione

C13H14O2

1-Methylbicyclo[4.3.1]decane

C11H20

2-Cyclododecylethoxymethanol

C15H30O2

Sodium;benzene;butanoic acid

C10H13NaO2

Butanediamide, N,N'-dihexyl-

C16H32N2O2

N4-ethylpyridine-3,4-diamine

C7H11N3

6-Bromo-5-chloroisoquinoline

C9H5BrClN

(2-Propoxyethoxy)acetic acid

C7H14O4

4a,16b-Dihydrotetraphenylene

C24H18

2,4-Difluoro-3-propoxyphenol

C9H10F2O2

PA(22:0/18:4(6Z,9Z,12Z,15Z))

C43H77O8P

N-benzhydrylundec-10-enamide

C24H31NO

3-Nitroheptadecanedioic acid

C17H31NO6

Aminomethylene diphosphonate

CH3NO5P2+2

m-Xylylene-bis-diglycolamide

C16H22N4O6

(3S)-3-methylpiperidin-1-ium

C6H14N+

PG(16:0/18:2(9Z,11E)+=O(13))

C40H73O11P

Dibutyl(phenylmethoxy)silane

C15H26OSi

Oxirane-2-carboxamide;phenol

C9H11NO3

Alumanylmethyl(ethoxy)silane

C3H11AlOSi

N,N-Dicarbamoyldecanediamide

C12H22N4O4

US11613532, Example A6-1-1-2

C23H35F3N6O2

2-Methyl-5-phenylselenophene

C11H10Se

2,2-Dibromoheptanedioic acid

C7H10Br2O4

Ethyl 2-benzoylhept-5-ynoate

C16H18O3

Benzyl(carboxymethyl)azanide

C9H10NO2-

3,5-Diethyl-1-benzothiophene

C12H14S

N-acetyl-N-adamantoylaniline

C19H23NO2

5-Quinolin-8-yliminopentanal

C14H14N2O

1-Hydroxy-1,5-benzodiazepine

C9H8N2O

HOCOCH2-D-Cys-D-Cys-D-Val-OH

C13H23N3O6S2

(8Z,13Z,18R,20Z)-strobilinin

C25H34O4

4-(Propylthio)-1,1'-biphenyl

C15H16S

3-Iodo-7-methyl-1-benzofuran

C9H7IO

H-Gly-Ala-Ala-Leu-Cys-Leu-OH

C23H42N6O7S

1-Chloro-4-methylcyclodecane

C11H21Cl

US10550102, Example 40-3 (+)

C38H44N4O4

H-Gly-Cys-Lys-Gly-Cys-Gly-OH

C18H33N7O7S2

7-(Dihexylamino)dodecan-1-ol

C24H51NO

1,8-Bis(2-ethylhexoxy)octane

C24H50O2

2,4-Dimethyloxan-3-ol;ethane

C11H26O2

Tos-Sar-N(Bn(4-Br))Ala-NHtBu

C24H32BrN3O4S

Oxacyclohexadecane-2,6-dione

C15H26O3

3-Octyloxyphenylboronic acid

C14H23BO3

Naphthalene-1,4-diol;yttrium

C10H8O2Y2

Methanol;titanium;dichloride

C4H16Cl2O4Ti-2

Ammonium a-hydroxy-o-toluate

C8H11NO3

Ethane;pent-2-yne;1,4-xylene

C15H24

2-(5-Iodothiophen-2-yl)furan

C8H5IOS

2,2,5-Trimethylhexyl formate

C10H20O2

9-Sulfotetracene-2-sulfinate

C18H11O5S2-