Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP029151	Methyl perillate	180.24	3	0	2	26.3	3
BIMP029152	5,6,7-Trimethoxy-9,10-dihydrophenanthrene-3,4-diol	302.32	3	2	5	68.15	3
BIMP029153	9Z-Pentacosene	350.70	12.8	0	0	0	21
BIMP029154	Dehydroascorbate (bicyclic form)	192.12	-3.1	4	7	116.45	0
BIMP029155	Epinortrachelogenin	374.40	2.5	3	7	105.45	6
BIMP029156	(11E)-4,6,12-trimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),11,15,18-heptaen-10-one	368.40	3.9	0	5	53.99	3
BIMP029157	2',3'-Dihydroxy-4',6'-dimethoxychalcone	300.30	3.5	2	5	75.99	5
BIMP029158	(1R,4R)-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-ol	210.31	1.7	2	2	40.46	2
BIMP029159	5-hydroxy-2-[(1R)-1-hydroxyethyl]benzo[f][1]benzofuran-4,9-dione	258.23	2	2	5	87.74	1
BIMP029160	5-Hydroxy-2-(1'-hydroxyethyl)naphtho[2,3-b]furan-4,9-dione	258.23	2	2	5	87.74	1
BIMP029161	8-hydroxy-2-[(1R)-1-hydroxyethyl]benzo[f][1]benzofuran-4,9-dione	258.23	2	2	5	87.74	1
BIMP029162	11-(3-Pentyloxiran-2-yl)undec-9-enoic acid	296.40	5.6	1	3	49.83	14
BIMP029163	Epipodophyllotoxin acetate	456.40	2.6	0	9	98.75	6
BIMP029164	[(5S,5aR,8aS,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate	456.40	2.6	0	9	98.75	6
BIMP029165	22,23-Dihydro-alpha-spinasterone	412.70	8.7	0	1	17.07	6
BIMP029166	[(1S,2R,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-(methoxymethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]methanol	402.50	3.2	1	6	66.38	8
BIMP029167	5,7,12-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid	364.40	-0.9	4	7	124.29	1
BIMP029168	Gibberellin A72	364.40	-0.9	4	7	124.29	1
BIMP029169	5,7-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid	348.40	0.1	3	6	104.06	1
BIMP029170	5,7-Dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylic acid	362.40	0.5	3	6	104.06	1
BIMP029171	8-Ormyl-12,14-dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid	378.40	-0.4	4	7	132.13	3
BIMP029172	2,14-Dihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid	352.50	2.1	4	5	97.99	2
BIMP029173	2,3,14-Trihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid	368.50	1.1	5	6	118.22	2
BIMP029174	7-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid	332.40	1.4	2	5	83.83	1
BIMP029175	8-Ormyl-14-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid	362.40	1	3	6	111.9	3

BIMP029151

Methyl perillate

180.24

3

0

2

26.3

3

BIMP029152

5,6,7-Trimethoxy-9,10-dihydrophenanthrene-3,4-diol

302.32

3

2

5

68.15

3

BIMP029153

9Z-Pentacosene

350.70

12.8

0

21

BIMP029154

Dehydroascorbate (bicyclic form)

192.12

-3.1

4

7

116.45

0

BIMP029155

Epinortrachelogenin

374.40

2.5

3

7

105.45

6

BIMP029156

(11E)-4,6,12-trimethoxy-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),11,15,18-heptaen-10-one

368.40

3.9

0

5

53.99

3

BIMP029157

2',3'-Dihydroxy-4',6'-dimethoxychalcone

300.30

3.5

2

5

75.99

5

BIMP029158

(1R,4R)-4-[(E,3R)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-2-en-1-ol

210.31

1.7

2

40.46

2

BIMP029159

5-hydroxy-2-[(1R)-1-hydroxyethyl]benzo[f][1]benzofuran-4,9-dione

258.23

2

5

87.74

1

BIMP029160

5-Hydroxy-2-(1'-hydroxyethyl)naphtho[2,3-b]furan-4,9-dione

258.23

2

5

87.74

1

BIMP029161

8-hydroxy-2-[(1R)-1-hydroxyethyl]benzo[f][1]benzofuran-4,9-dione

258.23

2

5

87.74

1

BIMP029162

11-(3-Pentyloxiran-2-yl)undec-9-enoic acid

296.40

5.6

1

3

49.83

14

BIMP029163

Epipodophyllotoxin acetate

456.40

2.6

0

9

98.75

6

BIMP029164

[(5S,5aR,8aS,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate

456.40

2.6

0

9

98.75

6

BIMP029165

22,23-Dihydro-alpha-spinasterone

412.70

8.7

0

1

17.07

6

BIMP029166

[(1S,2R,3R)-1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-(methoxymethyl)-1,2,3,4-tetrahydronaphthalen-2-yl]methanol

402.50

3.2

1

6

66.38

8

BIMP029167

5,7,12-Trihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

364.40

-0.9

4

7

124.29

1

BIMP029168

Gibberellin A72

364.40

-0.9

4

7

124.29

1

BIMP029169

5,7-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

348.40

0.1

3

6

104.06

1

BIMP029170

5,7-Dihydroxy-11-methyl-6-methylidene-12-oxo-13-oxapentacyclo[9.3.3.15,8.01,10.02,8]octadecane-9-carboxylic acid

362.40

0.5

3

6

104.06

1

BIMP029171

8-Ormyl-12,14-dihydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid

378.40

-0.4

4

7

132.13

3

BIMP029172

2,14-Dihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

352.50

2.1

4

5

97.99

2

BIMP029173

2,3,14-Trihydroxy-14-(hydroxymethyl)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid

368.50

1.1

5

6

118.22

2

BIMP029174

7-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid

332.40

1.4

2

5

83.83

1

BIMP029175

8-Ormyl-14-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid

362.40

1

3

6

111.9

3