Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP023526	(1S,4R)-1,2,3,6-tetramethylbicyclo[2.2.2]octa-2,5-diene	162.27	2.9	0	0	0	0
BIMP023527	Esculentoside L	973.10	0	11	20	321.28	12
BIMP023528	5'-(furan-3-yl)-10-hydroxy-8-methylspiro[3a,4,5,6,6a,8,9,10-octahydro-1H-benzo[d][2]benzofuran-7,3'-oxolane]-2',3-dione	360.40	2.2	1	6	85.97	1
BIMP023529	(1R,2R,5S)-2-[(1S)-1-carboxyethyl]-5-methylcyclopentane-1-carboxylic acid	200.23	1.7	2	4	74.6	3
BIMP023530	(2S,3S,5S,8aR)-5,8a-dimethyl-2,3,5,6,7,8-hexahydro-1H-naphthalene-2,3-diol	196.29	1.9	2	2	40.46	0
BIMP023531	(2R)-2-[(2R,5S)-5-ethenyl-5-methyloxolan-2-yl]propanoic acid	184.23	1.6	1	3	46.53	3
BIMP023532	2-Azetidinecarboxylic acid, 1-(3-hydroxypropyl)-, (2S)-	159.18	-2.6	2	4	60.77	4
BIMP023533	(2R)-2-hydroxy-4-methoxy-2-methyl-4-oxobutanoic acid	162.14	-0.8	2	5	83.83	4
BIMP023534	(3R)-3-hydroxy-4-methoxy-3-methyl-4-oxobutanoic acid	162.14	-0.8	2	5	83.83	4
BIMP023535	3-(2-Hydroxy-4-methoxyphenyl)prop-2-enal	178.18	1.4	1	3	46.53	3
BIMP023536	(E)-1-(2,6-dimethylphenyl)but-2-en-1-one	174.24	3.2	0	1	17.07	2
BIMP023537	Benzyl beta-primeveroside	402.40	-2.8	6	10	158.3	6
BIMP023538	3-Heptadecadienyl pyrocatechol	344.50	9.3	2	2	40.46	14
BIMP023539	3-Ethenyl-3,7-dimethyloct-6-enoic acid	196.29	3.7	1	2	37.3	6
BIMP023540	(3R)-6-hydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one	208.21	1.9	1	4	55.76	1
BIMP023541	Methyl dihydrogen phosphate	112.02	-1.6	2	4	76.57	1
BIMP023542	Diethyl chlorophosphate	172.55	1	0	3	45.34	4
BIMP023543	1-[(2S)-2,3-Dihydro-5-hydroxy-2-(1-methylethenyl)-6-benzofuranyl]ethanone	218.25	3.1	1	3	46.53	2
BIMP023544	2-(Hydroxymethyl)-6-(2-methoxy-4-propylphenoxy)oxane-3,4,5-triol	328.36	0.3	4	7	108.61	6
BIMP023545	3-Phenylpropyl beta-D-glucopyranoside	298.33	0.1	4	6	99.38	6
BIMP023546	(2S)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-carboxylic acid	204.22	2.8	1	3	46.53	2
BIMP023547	(S)-2-Heptyl acetate	158.24	2.9	0	2	26.3	6
BIMP023548	3-Methyl-3-buten-2-one	84.12	0.9	0	1	17.07	1
BIMP023549	6-Cyano-5-methoxy-12-methylindolo(2,3-a)carbazole	325.40	4.5	1	2	53.74	1
BIMP023550	5-Methoxy-11,12-dihydroindolo[2,3-a]carbazole-6-carbonitrile	311.30	4.5	2	2	64.6	1

BIMP023526

(1S,4R)-1,2,3,6-tetramethylbicyclo[2.2.2]octa-2,5-diene

162.27

2.9

0

BIMP023527

Esculentoside L

973.10

0

11

20

321.28

12

BIMP023528

5'-(furan-3-yl)-10-hydroxy-8-methylspiro[3a,4,5,6,6a,8,9,10-octahydro-1H-benzo[d][2]benzofuran-7,3'-oxolane]-2',3-dione

360.40

2.2

1

6

85.97

1

BIMP023529

(1R,2R,5S)-2-[(1S)-1-carboxyethyl]-5-methylcyclopentane-1-carboxylic acid

200.23

1.7

2

4

74.6

3

BIMP023530

(2S,3S,5S,8aR)-5,8a-dimethyl-2,3,5,6,7,8-hexahydro-1H-naphthalene-2,3-diol

196.29

1.9

2

40.46

0

BIMP023531

(2R)-2-[(2R,5S)-5-ethenyl-5-methyloxolan-2-yl]propanoic acid

184.23

1.6

1

3

46.53

3

BIMP023532

2-Azetidinecarboxylic acid, 1-(3-hydroxypropyl)-, (2S)-

159.18

-2.6

2

4

60.77

4

BIMP023533

(2R)-2-hydroxy-4-methoxy-2-methyl-4-oxobutanoic acid

162.14

-0.8

2

5

83.83

4

BIMP023534

(3R)-3-hydroxy-4-methoxy-3-methyl-4-oxobutanoic acid

162.14

-0.8

2

5

83.83

4

BIMP023535

3-(2-Hydroxy-4-methoxyphenyl)prop-2-enal

178.18

1.4

1

3

46.53

3

BIMP023536

(E)-1-(2,6-dimethylphenyl)but-2-en-1-one

174.24

3.2

0

1

17.07

2

BIMP023537

Benzyl beta-primeveroside

402.40

-2.8

6

10

158.3

6

BIMP023538

3-Heptadecadienyl pyrocatechol

344.50

9.3

2

40.46

14

BIMP023539

3-Ethenyl-3,7-dimethyloct-6-enoic acid

196.29

3.7

1

2

37.3

6

BIMP023540

(3R)-6-hydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one

208.21

1.9

1

4

55.76

1

BIMP023541

Methyl dihydrogen phosphate

112.02

-1.6

2

4

76.57

1

BIMP023542

Diethyl chlorophosphate

172.55

1

0

3

45.34

4

BIMP023543

1-[(2S)-2,3-Dihydro-5-hydroxy-2-(1-methylethenyl)-6-benzofuranyl]ethanone

218.25

3.1

1

3

46.53

2

BIMP023544

2-(Hydroxymethyl)-6-(2-methoxy-4-propylphenoxy)oxane-3,4,5-triol

328.36

0.3

4

7

108.61

6

BIMP023545

3-Phenylpropyl beta-D-glucopyranoside

298.33

0.1

4

6

99.38

6

BIMP023546

(2S)-2-prop-1-en-2-yl-2,3-dihydro-1-benzofuran-5-carboxylic acid

204.22

2.8

1

3

46.53

2

BIMP023547

(S)-2-Heptyl acetate

158.24

2.9

0

2

26.3

6

BIMP023548

3-Methyl-3-buten-2-one

84.12

0.9

0

1

17.07

1

BIMP023549

6-Cyano-5-methoxy-12-methylindolo(2,3-a)carbazole

325.40

4.5

1

2

53.74

1

BIMP023550

5-Methoxy-11,12-dihydroindolo[2,3-a]carbazole-6-carbonitrile

311.30

4.5

2

64.6

1