Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP012601	(Z)-1-phenylhex-1-en-4-yn-3-one	170.21	3.1	0	1	17.07	2
BIMP012602	Tropic acid	166.17	0.8	2	3	57.53	3
BIMP012603	(4R,5R)-4-hydroxy-5-(2-hydroxyethyl)-2-methylcyclopentene-1-carboxylic acid	186.20	-0.6	3	4	77.76	3
BIMP012604	1,1,3,5-Tetramethylcyclohexane	140.27	4.4	0	0	0	0
BIMP012605	(-)-7-Epi-alpha-selinene	204.35	5.2	0	0	0	1
BIMP012606	cis-1,2,3,4,5,6,8a-Hexahydro-4,7-dimethyl-1-isopropylnaphthalene	204.35	4	0	0	0	1
BIMP012607	Tetrahydroionol	198.34	4.3	1	1	20.23	3
BIMP012608	4-(3,5-Dimethoxy-4-hydroxyphenyl)-3-buten-2-one	222.24	1.6	1	4	55.76	4
BIMP012609	2-Naphthalenemethanol, 2,3,4,4a,5,6,7,8-octahydro-alpha,alpha,4a,8-tetramethyl-, (2R,4aS,8R)-	222.37	3.9	1	1	20.23	1
BIMP012610	6-Acetyl-7-hydroxy-2,3-dimethyl-chromone	232.23	2.2	1	4	67.51	1
BIMP012611	(1R,2S,7S,8S,9S)-2,6,6,9-tetramethyl-12-oxatricyclo[6.3.1.01,7]dodecan-9-ol	238.37	3.3	1	2	29.46	0
BIMP012612	(4E,6R,7R)-6-hydroxy-7-(2-hydroxypropan-2-yl)-4-methyl-10-methylidenecyclodec-4-en-1-one	252.35	1.9	2	3	57.53	1
BIMP012613	(1R,2R,4aR,5R,8aS)-2-(2-hydroxypropan-2-yl)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalene-1,5-diol	254.36	1.8	3	3	60.69	1
BIMP012614	(1S,3S,5R,8S)-3,8-dihydroxy-8-[(E,3R)-3-hydroxybut-1-enyl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one	256.29	-0.5	3	5	86.99	2
BIMP012615	Micromarin F	260.28	2.6	1	4	59.67	4
BIMP012616	2,2,6-Trimethyl-1-oxaspiro[2.5]oct-5-ene	152.23	1.8	0	1	12.53	0
BIMP012617	(2R,5S)-7-hydroxy-2-(2-hydroxypropan-2-yl)-5,8-dimethyl-3,5-dihydro-2H-1-benzoxepin-4-one	264.32	1.9	2	4	66.76	1
BIMP012618	(3aS,5R,5aS,8R,8aR,9aR)-5,8-dihydroxy-5,8-dimethyl-1-methylidene-3a,4,5a,6,7,8a,9,9a-octahydroazuleno[6,5-b]furan-2-one	266.33	1.2	2	4	66.76	0
BIMP012619	3-[(2S)-2-hydroxy-3-methylbut-3-enyl]-4-methoxy-1-methylquinolin-2-one	273.33	2.1	1	3	51.46	4
BIMP012620	(10Z,14E,16E)-10,14,16-Octadecatrien-12-ynoic acid	274.40	5.8	1	2	37.3	10
BIMP012621	N-Isobutyl-(2E,4E)-tetradecadienamide	279.50	6.6	1	1	29.1	12
BIMP012622	2-(4,9-Dimethoxy-2,3-dihydrobenzo[f][1]benzofuran-2-yl)propan-2-ol	288.34	3.1	1	4	47.92	3
BIMP012623	8-hydroxy-3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-1-methylquinolin-2-one	289.33	1.2	2	4	71.69	3
BIMP012624	2,4,4-Trimethylcyclopentanone	126.20	1.8	0	1	17.07	0
BIMP012625	(4aR,11E,12aR)-2,2,4,4,11-pentamethyl-7-methylidene-4a,5,6,9,10,12a-hexahydrocyclodeca[d][1,3]dioxin-8-one	292.40	2.9	0	3	35.53	0

BIMP012601

(Z)-1-phenylhex-1-en-4-yn-3-one

170.21

3.1

0

1

17.07

2

BIMP012602

Tropic acid

166.17

0.8

2

3

57.53

3

BIMP012603

(4R,5R)-4-hydroxy-5-(2-hydroxyethyl)-2-methylcyclopentene-1-carboxylic acid

186.20

-0.6

3

4

77.76

3

BIMP012604

1,1,3,5-Tetramethylcyclohexane

140.27

4.4

0

BIMP012605

(-)-7-Epi-alpha-selinene

204.35

5.2

0

1

BIMP012606

cis-1,2,3,4,5,6,8a-Hexahydro-4,7-dimethyl-1-isopropylnaphthalene

204.35

4

0

1

BIMP012607

Tetrahydroionol

198.34

4.3

1

20.23

3

BIMP012608

4-(3,5-Dimethoxy-4-hydroxyphenyl)-3-buten-2-one

222.24

1.6

1

4

55.76

4

BIMP012609

2-Naphthalenemethanol, 2,3,4,4a,5,6,7,8-octahydro-alpha,alpha,4a,8-tetramethyl-, (2R,4aS,8R)-

222.37

3.9

1

20.23

1

BIMP012610

6-Acetyl-7-hydroxy-2,3-dimethyl-chromone

232.23

2.2

1

4

67.51

1

BIMP012611

(1R,2S,7S,8S,9S)-2,6,6,9-tetramethyl-12-oxatricyclo[6.3.1.01,7]dodecan-9-ol

238.37

3.3

1

2

29.46

0

BIMP012612

(4E,6R,7R)-6-hydroxy-7-(2-hydroxypropan-2-yl)-4-methyl-10-methylidenecyclodec-4-en-1-one

252.35

1.9

2

3

57.53

1

BIMP012613

(1R,2R,4aR,5R,8aS)-2-(2-hydroxypropan-2-yl)-4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalene-1,5-diol

254.36

1.8

3

60.69

1

BIMP012614

(1S,3S,5R,8S)-3,8-dihydroxy-8-[(E,3R)-3-hydroxybut-1-enyl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one

256.29

-0.5

3

5

86.99

2

BIMP012615

Micromarin F

260.28

2.6

1

4

59.67

4

BIMP012616

2,2,6-Trimethyl-1-oxaspiro[2.5]oct-5-ene

152.23

1.8

0

1

12.53

0

BIMP012617

(2R,5S)-7-hydroxy-2-(2-hydroxypropan-2-yl)-5,8-dimethyl-3,5-dihydro-2H-1-benzoxepin-4-one

264.32

1.9

2

4

66.76

1

BIMP012618

(3aS,5R,5aS,8R,8aR,9aR)-5,8-dihydroxy-5,8-dimethyl-1-methylidene-3a,4,5a,6,7,8a,9,9a-octahydroazuleno[6,5-b]furan-2-one

266.33

1.2

2

4

66.76

0

BIMP012619

3-[(2S)-2-hydroxy-3-methylbut-3-enyl]-4-methoxy-1-methylquinolin-2-one

273.33

2.1

1

3

51.46

4

BIMP012620

(10Z,14E,16E)-10,14,16-Octadecatrien-12-ynoic acid

274.40

5.8

1

2

37.3

10

BIMP012621

N-Isobutyl-(2E,4E)-tetradecadienamide

279.50

6.6

1

29.1

12

BIMP012622

2-(4,9-Dimethoxy-2,3-dihydrobenzo[f][1]benzofuran-2-yl)propan-2-ol

288.34

3.1

1

4

47.92

3

BIMP012623

8-hydroxy-3-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxy-1-methylquinolin-2-one

289.33

1.2

2

4

71.69

3

BIMP012624

2,4,4-Trimethylcyclopentanone

126.20

1.8

0

1

17.07

0

BIMP012625

(4aR,11E,12aR)-2,2,4,4,11-pentamethyl-7-methylidene-4a,5,6,9,10,12a-hexahydrocyclodeca[d][1,3]dioxin-8-one

292.40

2.9

0

3

35.53

0