Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP019226	CID 11972492	467.60	-0.6	3	8	100.85	6
BIMP019227	CID 11972501	378.40	0.6	2	7	105.59	5
BIMP019228	(3R,10S,13S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-2',10,13-trimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindole]-1'-one	462.70	7.1	0	2	23.55	2
BIMP019229	CID 11972532	248.32	2.3	0	3	38.83	0
BIMP019230	10-epi-Acor-3-en-5-one	218.33	3.8	0	1	17.07	1
BIMP019231	alpha-Acorenol	222.37	3.6	1	1	20.23	1
BIMP019232	2''-Epifraxamoside	538.50	-1.1	5	13	190.67	3
BIMP019233	Ginkgolide B	424.40	-0.4	3	10	148.82	1
BIMP019234	(2R,3S,5R,6R)-(113C)cyclohexane-1,2,3,4,5,6-hexol	181.15	-3.7	6	6	121.38	0
BIMP019235	(2Z,4E)-5-deuterio-5-[(1S,6S)-1-hydroxy-2,6-dimethyl-4-oxo-6-(trideuteriomethyl)cyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid	268.34	1.6	2	4	74.6	3
BIMP019236	(6Z,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene	410.70	11.6	0	0	0	15
BIMP019237	Galbelgin	372.50	4.4	0	5	46.15	6
BIMP019238	Ganschisandrin	372.50	4.4	0	5	46.15	6
BIMP019239	Suaveolol	306.50	3.9	2	2	40.46	2
BIMP019240	(3S,3aR,3bR,4S,7R,7aR)-4-Isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-ol	222.37	3.9	1	1	20.23	1
BIMP019241	methyl (Z)-4-(1H-indol-3-yl)-2-methyl-4-oxobut-2-enoate	243.26	2.5	1	3	59.16	4
BIMP019242	[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] (E)-3-phenylprop-2-enoate	310.30	4	1	4	55.76	7
BIMP019243	Benzene, 1,5-dibromo-2-(3,5-dibromo-2-methoxyphenoxy)-3-methoxy-	545.80	6.2	0	3	27.69	4
BIMP019244	Monardaein	913.80		10	22	363.56	19
BIMP019245	Ethyl isopentyl succinate	216.27	2.5	0	4	52.6	9
BIMP019246	CID 11979494	1693.60		8	34	433.18	20
BIMP019247	Oleoresin tumeric	1015.10		6	15	251.49	21
BIMP019248	Isocitric acid	192.12	-1.8	4	7	132.13	5
BIMP019249	Ethyl 2-furoate	140.14	1.5	0	3	39.44	3
BIMP019250	1,3-Dihydroxypropan-2-yl docos-13-enoate	412.60	8.5	2	4	66.76	23

BIMP019226

CID 11972492

467.60

-0.6

3

8

100.85

6

BIMP019227

CID 11972501

378.40

0.6

2

7

105.59

5

BIMP019228

(3R,10S,13S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-2',10,13-trimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,3'-isoindole]-1'-one

462.70

7.1

0

2

23.55

2

BIMP019229

CID 11972532

248.32

2.3

0

3

38.83

0

BIMP019230

10-epi-Acor-3-en-5-one

218.33

3.8

0

1

17.07

1

BIMP019231

alpha-Acorenol

222.37

3.6

1

20.23

1

BIMP019232

2''-Epifraxamoside

538.50

-1.1

5

13

190.67

3

BIMP019233

Ginkgolide B

424.40

-0.4

3

10

148.82

1

BIMP019234

(2R,3S,5R,6R)-(113C)cyclohexane-1,2,3,4,5,6-hexol

181.15

-3.7

6

121.38

0

BIMP019235

(2Z,4E)-5-deuterio-5-[(1S,6S)-1-hydroxy-2,6-dimethyl-4-oxo-6-(trideuteriomethyl)cyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid

268.34

1.6

2

4

74.6

3

BIMP019236

(6Z,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene

410.70

11.6

0

15

BIMP019237

Galbelgin

372.50

4.4

0

5

46.15

6

BIMP019238

Ganschisandrin

372.50

4.4

0

5

46.15

6

BIMP019239

Suaveolol

306.50

3.9

2

40.46

2

BIMP019240

(3S,3aR,3bR,4S,7R,7aR)-4-Isopropyl-3,7-dimethyloctahydro-1H-cyclopenta[1,3]cyclopropa[1,2]benzen-3-ol

222.37

3.9

1

20.23

1

BIMP019241

methyl (Z)-4-(1H-indol-3-yl)-2-methyl-4-oxobut-2-enoate

243.26

2.5

1

3

59.16

4

BIMP019242

[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl] (E)-3-phenylprop-2-enoate

310.30

4

1

4

55.76

7

BIMP019243

Benzene, 1,5-dibromo-2-(3,5-dibromo-2-methoxyphenoxy)-3-methoxy-

545.80

6.2

0

3

27.69

4

BIMP019244

Monardaein

913.80

10

22

363.56

19

BIMP019245

Ethyl isopentyl succinate

216.27

2.5

0

4

52.6

9

BIMP019246

CID 11979494

1693.60

8

34

433.18

20

BIMP019247

Oleoresin tumeric

1015.10

6

15

251.49

21

BIMP019248

Isocitric acid

192.12

-1.8

4

7

132.13

5

BIMP019249

Ethyl 2-furoate

140.14

1.5

0

3

39.44

3

BIMP019250

1,3-Dihydroxypropan-2-yl docos-13-enoate

412.60

8.5

2

4

66.76

23