Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP023651	Saringosterol 3-glucoside	590.80	5.9	5	7	119.61	9
BIMP023652	Mono-trans-p-coumaroylmesotartaric acid	310.26	0.4	4	8	141.36	8
BIMP023653	Dieporeticenin	572.90	13.2	0	4	51.36	28
BIMP023654	Diisodityrosine	718.70	-7.4	10	16	312.2	17
BIMP023655	5'-Methoxycastavinol	580.50	-0.6	7	14	214.06	7
BIMP023656	1,2-Epoxy-1,2,7,7',8,8',11,12-octahydro-psi,psi-carotene	558.90	14.1	0	1	12.53	19
BIMP023657	1,2-Epoxy-1,2,7,7',8,8',11',12'-octahydro-psi,psi-carotene	560.90	14.6	0	1	12.53	20
BIMP023658	5,8:5',8'-Diepoxy-5,5',8,8'-tetrahydro-b,b-caroten-3-ol	584.90	10.2	1	3	38.69	8
BIMP023659	Caffeoylputrescine	250.29	0.8	4	4	95.58	6
BIMP023660	7,8-Dihydro-8-hydroxy-4-methoxy-7-methyl-5H-furo[2,3-g][2]benzopyran-5-one	248.23	1.5	1	5	68.9	1
BIMP023661	Simonin I	1277.60	13.6	5	21	280.19	32
BIMP023662	Simonin V	1293.60	9.8	8	24	333.04	30
BIMP023663	17-[(Z)-5-ethyl-6-methylhept-3-en-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one	426.70	7.5	1	2	37.3	5
BIMP023664	Stigmasta-5,24(28)-dien-3-ol, (3beta,24E)-	412.70	8.9	1	1	20.23	5
BIMP023665	Euglobal VII	454.60	6.9	2	5	83.83	4
BIMP023666	Melongoside O	919.10	-0.1	12	19	307.37	13
BIMP023667	Melongoside P	1067.20	-0.4	14	23	366.29	15
BIMP023668	Taraxacoside	398.40	-1.1	4	10	151.98	7
BIMP023669	24S,25S-Epoxy-4a,7a-dihydroxy-1-oxowithanolide	474.60	4	2	6	96.36	2
BIMP023670	Cyanidin 3-(3-glucosyl-6-malonylglucoside) 4'-glucoside	855.80		14	21	359.13	14
BIMP023671	4b,5a,14a,17b,20S-Pentahydroxy-3a,6a-oxido-1-oxo-24-ergosten-26,22R-olide	520.60	-0.3	5	9	153.75	2
BIMP023672	24-Methylcholesta-5,7-dien-3-beta-ol	398.70	8.2	1	1	20.23	5
BIMP023673	N-[2-Hydroxy-2-(4-hydroxyphenyl)ethyl]cinnamide	283.32	2.1	3	3	69.56	5
BIMP023674	Marmeline	351.40	3.9	2	3	58.56	8
BIMP023675	Mahanimbinine	349.50	5.3	2	2	45.25	4

BIMP023651

Saringosterol 3-glucoside

590.80

5.9

5

7

119.61

9

BIMP023652

Mono-trans-p-coumaroylmesotartaric acid

310.26

0.4

4

8

141.36

8

BIMP023653

Dieporeticenin

572.90

13.2

0

4

51.36

28

BIMP023654

Diisodityrosine

718.70

-7.4

10

16

312.2

17

BIMP023655

5'-Methoxycastavinol

580.50

-0.6

7

14

214.06

7

BIMP023656

1,2-Epoxy-1,2,7,7',8,8',11,12-octahydro-psi,psi-carotene

558.90

14.1

0

1

12.53

19

BIMP023657

1,2-Epoxy-1,2,7,7',8,8',11',12'-octahydro-psi,psi-carotene

560.90

14.6

0

1

12.53

20

BIMP023658

5,8:5',8'-Diepoxy-5,5',8,8'-tetrahydro-b,b-caroten-3-ol

584.90

10.2

1

3

38.69

8

BIMP023659

Caffeoylputrescine

250.29

0.8

4

95.58

6

BIMP023660

7,8-Dihydro-8-hydroxy-4-methoxy-7-methyl-5H-furo[2,3-g][2]benzopyran-5-one

248.23

1.5

1

5

68.9

1

BIMP023661

Simonin I

1277.60

13.6

5

21

280.19

32

BIMP023662

Simonin V

1293.60

9.8

8

24

333.04

30

BIMP023663

17-[(Z)-5-ethyl-6-methylhept-3-en-2-yl]-3-hydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one

426.70

7.5

1

2

37.3

5

BIMP023664

Stigmasta-5,24(28)-dien-3-ol, (3beta,24E)-

412.70

8.9

1

20.23

5

BIMP023665

Euglobal VII

454.60

6.9

2

5

83.83

4

BIMP023666

Melongoside O

919.10

-0.1

12

19

307.37

13

BIMP023667

Melongoside P

1067.20

-0.4

14

23

366.29

15

BIMP023668

Taraxacoside

398.40

-1.1

4

10

151.98

7

BIMP023669

24S,25S-Epoxy-4a,7a-dihydroxy-1-oxowithanolide

474.60

4

2

6

96.36

2

BIMP023670

Cyanidin 3-(3-glucosyl-6-malonylglucoside) 4'-glucoside

855.80

14

21

359.13

14

BIMP023671

4b,5a,14a,17b,20S-Pentahydroxy-3a,6a-oxido-1-oxo-24-ergosten-26,22R-olide

520.60

-0.3

5

9

153.75

2

BIMP023672

24-Methylcholesta-5,7-dien-3-beta-ol

398.70

8.2

1

20.23

5

BIMP023673

N-[2-Hydroxy-2-(4-hydroxyphenyl)ethyl]cinnamide

283.32

2.1

3

69.56

5

BIMP023674

Marmeline

351.40

3.9

2

3

58.56

8

BIMP023675

Mahanimbinine

349.50

5.3

2

45.25

4