Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP010226	alpha-Farnesene-d6	210.39	6.1	0	0	0	6
BIMP010227	Methyl 2,6-dihydroxy-4-quinolinecarboxylate	219.19	0.6	2	4	79.39	2
BIMP010228	(1R,2S,5E,9S,10S)-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-ene-2,9-diol	238.37	2.6	2	2	40.46	0
BIMP010229	Napabucasin	240.21	2.3	0	4	64.35	1
BIMP010230	methyl (1S,4S,7S,8S,9S,11S)-4,9-dihydroxy-2,10-dioxatricyclo[5.3.1.04,11]undec-5-ene-8-carboxylate	242.22	-0.6	2	6	85.22	2
BIMP010231	3,4-Diaminotoluene	122.17	0.6	2	2	52.04	0
BIMP010232	Dehydro-4-methoxycyclobrassinin	262.40	3.5	0	5	88.55	2
BIMP010233	(3aR,4S,6E,10E,11aR)-4-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one	264.32	0.6	2	4	66.76	1
BIMP010234	(-)-Sivasinolide	264.32	1	2	4	66.76	0
BIMP010235	7-Hydroxy-5-methoxy-6-methylflavan	270.32	3.8	1	3	38.69	2
BIMP010236	Thunberginol C	272.25	2.8	3	5	86.99	1
BIMP010237	1,3,5,6,7-Pentahydroxyxanthon	276.20	1.7	5	7	131.36	0
BIMP010238	(4S,5S)-5-[(1R,2S)-2-hydroxy-2-methyl-5-oxocyclopent-3-en-1-yl]-3-methylidene-4-(3-oxobutyl)oxolan-2-one	278.30	0	1	5	80.67	4
BIMP010239	(3R)-3-[(Z)-[(2R)-2-hydroxy-2-methyl-5-oxocyclopent-3-en-1-ylidene]methyl]-2-methylidene-6-oxoheptanoic acid	278.30	0.3	2	5	91.67	6
BIMP010240	(1R,3S,5aS,9aS,9bR)-1,3-dimethoxy-6,6,9a-trimethyl-1,3,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzofuran	280.40	3.6	0	3	27.69	2
BIMP010241	Deoxybuddlejone	284.40	5.8	0	1	17.07	1
BIMP010242	Luotonin A	285.30	2.7	0	3	47.78	0
BIMP010243	(1R,4R,9R,10S,13R)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one	286.50	5.9	0	1	17.07	0
BIMP010244	(5aR,8S,9aS,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[f]azulen-8-ol	288.50	4.4	1	1	20.23	1
BIMP010245	epsilon-Cotonefuran	290.27	2.9	2	6	81.29	3
BIMP010246	12-Oxophytodienoic acid	292.40	4.7	1	3	54.37	11
BIMP010247	Dendocarbin J	294.40	2.9	1	4	55.76	2
BIMP010248	(4aS,10aS)-7-hydroxy-1,1,4a-trimethyl-8-propan-2-yl-10,10a-dihydro-9H-phenanthren-4-one	298.40	5.1	1	2	37.3	1
BIMP010249	(1R,4S,6S,9S,10S,13S)-6-hydroxy-5,5,9,13-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadec-14-en-7-one	302.50	5	1	2	37.3	0
BIMP010250	(-)-Stephanine; (R)-(-)-Stephanine; 8-Methoxy-1,2-(methylenedioxy)-6abeta-aporphine; Stephanin; l-Stephanine	309.40	3.3	0	4	30.93	1

BIMP010226

alpha-Farnesene-d6

210.39

6.1

0

6

BIMP010227

Methyl 2,6-dihydroxy-4-quinolinecarboxylate

219.19

0.6

2

4

79.39

2

BIMP010228

(1R,2S,5E,9S,10S)-1,5,8,8-tetramethylbicyclo[8.1.0]undec-5-ene-2,9-diol

238.37

2.6

2

40.46

0

BIMP010229

Napabucasin

240.21

2.3

0

4

64.35

1

BIMP010230

methyl (1S,4S,7S,8S,9S,11S)-4,9-dihydroxy-2,10-dioxatricyclo[5.3.1.04,11]undec-5-ene-8-carboxylate

242.22

-0.6

2

6

85.22

2

BIMP010231

3,4-Diaminotoluene

122.17

0.6

2

52.04

0

BIMP010232

Dehydro-4-methoxycyclobrassinin

262.40

3.5

0

5

88.55

2

BIMP010233

(3aR,4S,6E,10E,11aR)-4-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one

264.32

0.6

2

4

66.76

1

BIMP010234

(-)-Sivasinolide

264.32

1

2

4

66.76

0

BIMP010235

7-Hydroxy-5-methoxy-6-methylflavan

270.32

3.8

1

3

38.69

2

BIMP010236

Thunberginol C

272.25

2.8

3

5

86.99

1

BIMP010237

1,3,5,6,7-Pentahydroxyxanthon

276.20

1.7

5

7

131.36

0

BIMP010238

(4S,5S)-5-[(1R,2S)-2-hydroxy-2-methyl-5-oxocyclopent-3-en-1-yl]-3-methylidene-4-(3-oxobutyl)oxolan-2-one

278.30

0

1

5

80.67

4

BIMP010239

(3R)-3-[(Z)-[(2R)-2-hydroxy-2-methyl-5-oxocyclopent-3-en-1-ylidene]methyl]-2-methylidene-6-oxoheptanoic acid

278.30

0.3

2

5

91.67

6

BIMP010240

(1R,3S,5aS,9aS,9bR)-1,3-dimethoxy-6,6,9a-trimethyl-1,3,5,5a,7,8,9,9b-octahydrobenzo[e][2]benzofuran

280.40

3.6

0

3

27.69

2

BIMP010241

Deoxybuddlejone

284.40

5.8

0

1

17.07

1

BIMP010242

Luotonin A

285.30

2.7

0

3

47.78

0

BIMP010243

(1R,4R,9R,10S,13R)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-one

286.50

5.9

0

1

17.07

0

BIMP010244

(5aR,8S,9aS,10aR)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[f]azulen-8-ol

288.50

4.4

1

20.23

1

BIMP010245

epsilon-Cotonefuran

290.27

2.9

2

6

81.29

3

BIMP010246

12-Oxophytodienoic acid

292.40

4.7

1

3

54.37

11

BIMP010247

Dendocarbin J

294.40

2.9

1

4

55.76

2

BIMP010248

(4aS,10aS)-7-hydroxy-1,1,4a-trimethyl-8-propan-2-yl-10,10a-dihydro-9H-phenanthren-4-one

298.40

5.1

1

2

37.3

1

BIMP010249

(1R,4S,6S,9S,10S,13S)-6-hydroxy-5,5,9,13-tetramethyltetracyclo[11.2.1.01,10.04,9]hexadec-14-en-7-one

302.50

5

1

2

37.3

0

BIMP010250

(-)-Stephanine; (R)-(-)-Stephanine; 8-Methoxy-1,2-(methylenedioxy)-6abeta-aporphine; Stephanin; l-Stephanine

309.40

3.3

0

4

30.93

1