Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP018701	2-Methylanthracene	192.25	5.1	0	0	0	0
BIMP018702	Octanoate	143.20	3.7	0	2	40.13	5
BIMP018703	beta-Chaconine	705.90	3.4	6	11	161.54	5
BIMP018704	Campestanol	402.70	9.6	1	1	20.23	5
BIMP018705	Rheinanthrone	270.24	2.7	3	5	94.83	1
BIMP018706	Dopachrome	193.16	-0.7	2	5	83.47	1
BIMP018707	Maculosin	260.29	1	2	3	69.64	2
BIMP018708	2-(4-methoxy-1H-indol-3-yl)acetonitrile	186.21	1.7	1	2	48.81	2
BIMP018709	4-Methoxybiphenyl	184.23	4	0	1	9.23	2
BIMP018710	Cyasterone	520.70	1	5	8	144.52	4
BIMP018711	Daphnetoxin	482.50	1.5	3	8	117.98	3
BIMP018712	Cleistanthin B	542.50	1.8	4	12	162.6	6
BIMP018713	Aristolic acid	296.27	3.7	1	5	64.99	2
BIMP018714	CID 11947793	685.90	5.8	2	7	102.54	1
BIMP018715	Methylecgonidine	181.23	1.1	0	3	29.54	2
BIMP018716	gerontoxanthone A	394.40	5	2	6	89.13	0
BIMP018717	CID 11948660	524.50	-1.3	7	13	208.13	8
BIMP018718	Specioside	508.50	-0.9	6	12	187.9	8
BIMP018719	[(2S,3R,4R,5R)-4-(hydroxymethyl)-2-(7-methoxy-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)oxolan-3-yl]methyl acetate	490.50	2.3	1	10	111.14	10
BIMP018720	Panepoxydione	208.21	1	1	4	66.9	2
BIMP018721	Shanzhiside	392.35	-2.9	7	11	186.37	4
BIMP018722	Bacopaside N1	797.00	3.1	8	14	217.22	7
BIMP018723	7-Methyl-5-(1-methylethyl)-2H-naphtho(1,8-bc)furan-3,4-diol	244.28	3.5	2	3	49.69	1
BIMP018724	Isopentenyl pyrophosphate	246.09	-0.9	3	7	132.91	6
BIMP018725	2-Aminoacetophenone	135.16	0.8	1	2	43.09	2

BIMP018701

2-Methylanthracene

192.25

5.1

0

BIMP018702

Octanoate

143.20

3.7

0

2

40.13

5

BIMP018703

beta-Chaconine

705.90

3.4

6

11

161.54

5

BIMP018704

Campestanol

402.70

9.6

1

20.23

5

BIMP018705

Rheinanthrone

270.24

2.7

3

5

94.83

1

BIMP018706

Dopachrome

193.16

-0.7

2

5

83.47

1

BIMP018707

Maculosin

260.29

1

2

3

69.64

2

BIMP018708

2-(4-methoxy-1H-indol-3-yl)acetonitrile

186.21

1.7

1

2

48.81

2

BIMP018709

4-Methoxybiphenyl

184.23

4

0

1

9.23

2

BIMP018710

Cyasterone

520.70

1

5

8

144.52

4

BIMP018711

Daphnetoxin

482.50

1.5

3

8

117.98

3

BIMP018712

Cleistanthin B

542.50

1.8

4

12

162.6

6

BIMP018713

Aristolic acid

296.27

3.7

1

5

64.99

2

BIMP018714

CID 11947793

685.90

5.8

2

7

102.54

1

BIMP018715

Methylecgonidine

181.23

1.1

0

3

29.54

2

BIMP018716

gerontoxanthone A

394.40

5

2

6

89.13

0

BIMP018717

CID 11948660

524.50

-1.3

7

13

208.13

8

BIMP018718

Specioside

508.50

-0.9

6

12

187.9

8

BIMP018719

[(2S,3R,4R,5R)-4-(hydroxymethyl)-2-(7-methoxy-1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)oxolan-3-yl]methyl acetate

490.50

2.3

1

10

111.14

10

BIMP018720

Panepoxydione

208.21

1

4

66.9

2

BIMP018721

Shanzhiside

392.35

-2.9

7

11

186.37

4

BIMP018722

Bacopaside N1

797.00

3.1

8

14

217.22

7

BIMP018723

7-Methyl-5-(1-methylethyl)-2H-naphtho(1,8-bc)furan-3,4-diol

244.28

3.5

2

3

49.69

1

BIMP018724

Isopentenyl pyrophosphate

246.09

-0.9

3

7

132.91

6

BIMP018725

2-Aminoacetophenone

135.16

0.8

1

2

43.09

2