Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP012326	Dimethyl sulfide	62.14	0.9	0	1	25.3	0
BIMP012327	Flavone	222.24	3.6	0	2	30.21	1
BIMP012328	(1R,2R,5R,8S,9S)-4,4,8-trimethyltricyclo[6.3.1.01,5]dodecane-2,9-diol	238.37	2.9	2	2	40.46	0
BIMP012329	CID 10682256	252.35	1.5	2	3	57.53	1
BIMP012330	(2R)-1-[(2S,6R)-6-[(2R)-2-hydroxybutyl]-1-methyl-3,6-dihydro-2H-pyridin-2-yl]pentan-2-ol	255.40	2.7	2	3	43.7	7
BIMP012331	8-[(1Z)-3-(hydroxymethyl)buta-1,3-dienyl]-7-methoxychromen-2-one	258.27	2.7	1	4	59.67	4
BIMP012332	(1R,8aR)-1-(furan-3-yl)-5-(hydroxymethyl)-8a-methyl-7,8-dihydro-1H-isochromen-3-one	260.28	1	1	4	59.67	2
BIMP012333	(4aS)-1-(hydroxymethyl)-3-methoxy-4a-methyl-7-propan-2-yl-5,6-dihydronaphthalen-2-one	262.34	2.9	1	3	46.53	3
BIMP012334	(4aS,5R,8aR,9aS)-9a-hydroxy-3,4a,5-trimethyl-4,5,7,8,8a,9-hexahydrobenzo[f][1]benzofuran-2,6-dione	264.32	1.1	1	4	63.6	0
BIMP012335	Curcolonol	264.32	1.3	2	4	70.67	0
BIMP012336	Dihydroabietylamine	285.50	5.4	1	1	26.02	2
BIMP012337	(S)-1,1-bis(4-Methoxyphenyl)propan-2-ol	272.34	2.9	1	3	38.69	5
BIMP012338	(11R)-11-hydroxyhexadecanoic acid	272.42	5.2	2	3	57.53	14
BIMP012339	(1R,5R,7R,8S,12S)-7,12-dihydroxy-1,5-dimethyl-8-propan-2-yl-9,10-dioxatricyclo[6.2.2.02,6]dodec-2(6)-en-3-one	282.33	0	2	5	75.99	1
BIMP012340	(3S)-octadecane-1,3-diol	286.50	7	2	2	40.46	16
BIMP012341	Tryptophol	161.20	1.8	2	1	36.02	2
BIMP012342	caruilignan C	294.30	1.2	0	6	63.22	4
BIMP012343	[(1Z,6R,7R,8S)-6,7-dihydroxy-5-methylidene-8-propan-2-ylcyclodecen-1-yl]methyl acetate	296.40	1.8	2	4	66.76	4
BIMP012344	(2R,4aR,6R,7S,8S,8aR)-6-(hydroxymethyl)-2-(methylsulfonylmethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol	298.31	-2.3	3	8	130.9	3
BIMP012345	(3R,4R)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one	298.30	3.3	2	4	66.76	4
BIMP012346	4-Methoxybenzyl beta-D-glucopyranoside	300.30	-0.7	4	7	108.61	5
BIMP012347	[(1R,2R)-3-formyl-4-methyl-2-(2-oxoethyl)cyclopent-3-en-1-yl] 4-methoxybenzoate	302.32	1.3	0	5	69.67	7
BIMP012348	(1S,3R,4R,7R)-3-hydroxy-3-methyl-7-(6-methylhepta-1,5-dien-2-yl)-6-propan-2-ylbicyclo[2.2.2]oct-5-en-2-one	302.50	4.4	1	2	37.3	5
BIMP012349	Trimethylbenzene	120.19	3.6	0	0	0	0
BIMP012350	Clausevatine D	311.30	2.9	3	4	82.55	1

BIMP012326

Dimethyl sulfide

62.14

0.9

0

1

25.3

0

BIMP012327

Flavone

222.24

3.6

0

2

30.21

1

BIMP012328

(1R,2R,5R,8S,9S)-4,4,8-trimethyltricyclo[6.3.1.01,5]dodecane-2,9-diol

238.37

2.9

2

40.46

0

BIMP012329

CID 10682256

252.35

1.5

2

3

57.53

1

BIMP012330

(2R)-1-[(2S,6R)-6-[(2R)-2-hydroxybutyl]-1-methyl-3,6-dihydro-2H-pyridin-2-yl]pentan-2-ol

255.40

2.7

2

3

43.7

7

BIMP012331

8-[(1Z)-3-(hydroxymethyl)buta-1,3-dienyl]-7-methoxychromen-2-one

258.27

2.7

1

4

59.67

4

BIMP012332

(1R,8aR)-1-(furan-3-yl)-5-(hydroxymethyl)-8a-methyl-7,8-dihydro-1H-isochromen-3-one

260.28

1

4

59.67

2

BIMP012333

(4aS)-1-(hydroxymethyl)-3-methoxy-4a-methyl-7-propan-2-yl-5,6-dihydronaphthalen-2-one

262.34

2.9

1

3

46.53

3

BIMP012334

(4aS,5R,8aR,9aS)-9a-hydroxy-3,4a,5-trimethyl-4,5,7,8,8a,9-hexahydrobenzo[f][1]benzofuran-2,6-dione

264.32

1.1

1

4

63.6

0

BIMP012335

Curcolonol

264.32

1.3

2

4

70.67

0

BIMP012336

Dihydroabietylamine

285.50

5.4

1

26.02

2

BIMP012337

(S)-1,1-bis(4-Methoxyphenyl)propan-2-ol

272.34

2.9

1

3

38.69

5

BIMP012338

(11R)-11-hydroxyhexadecanoic acid

272.42

5.2

2

3

57.53

14

BIMP012339

(1R,5R,7R,8S,12S)-7,12-dihydroxy-1,5-dimethyl-8-propan-2-yl-9,10-dioxatricyclo[6.2.2.02,6]dodec-2(6)-en-3-one

282.33

0

2

5

75.99

1

BIMP012340

(3S)-octadecane-1,3-diol

286.50

7

2

40.46

16

BIMP012341

Tryptophol

161.20

1.8

2

1

36.02

2

BIMP012342

caruilignan C

294.30

1.2

0

6

63.22

4

BIMP012343

[(1Z,6R,7R,8S)-6,7-dihydroxy-5-methylidene-8-propan-2-ylcyclodecen-1-yl]methyl acetate

296.40

1.8

2

4

66.76

4

BIMP012344

(2R,4aR,6R,7S,8S,8aR)-6-(hydroxymethyl)-2-(methylsulfonylmethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol

298.31

-2.3

3

8

130.9

3

BIMP012345

(3R,4R)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one

298.30

3.3

2

4

66.76

4

BIMP012346

4-Methoxybenzyl beta-D-glucopyranoside

300.30

-0.7

4

7

108.61

5

BIMP012347

[(1R,2R)-3-formyl-4-methyl-2-(2-oxoethyl)cyclopent-3-en-1-yl] 4-methoxybenzoate

302.32

1.3

0

5

69.67

7

BIMP012348

(1S,3R,4R,7R)-3-hydroxy-3-methyl-7-(6-methylhepta-1,5-dien-2-yl)-6-propan-2-ylbicyclo[2.2.2]oct-5-en-2-one

302.50

4.4

1

2

37.3

5

BIMP012349

Trimethylbenzene

120.19

3.6

0

BIMP012350

Clausevatine D

311.30

2.9

3

4

82.55

1