Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP031676	ent-11alpha-Hydroxy-15-oxokaur-16-en-19-oic acid	332.40	3.1	2	4	74.6	1
BIMP031677	[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 11-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate	494.60	1.3	5	9	153.75	4
BIMP031678	methyl (6R)-1,6-dimethyl-10,11-dioxo-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-6-carboxylate	338.40	3.2	0	5	73.58	2
BIMP031679	Methyl tanshinonate	338.40	3.2	0	5	73.58	2
BIMP031680	7-hydroxy-1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione	310.30	3	1	4	67.51	0
BIMP031681	1-((E)-(S)-3,7-Dimethyl-3-vinyl-octa-1,6-dienyl)-4-methoxy-benzene	270.40	6.4	0	1	9.23	7
BIMP031682	1,3-Dimethyl-3-(4-methylpent-3-enyl)-2-oxabicyclo[2.2.2]octan-6-one	236.35	3.2	0	2	26.3	3
BIMP031683	2-[4-[Hydroxy-[5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	538.50	-0.5	7	12	187.76	9
BIMP031684	Aromadendrin 4'-glucoside	450.40	0	7	11	186.37	4
BIMP031685	[(1R,4Z,9S,11R)-11-(hydroxymethyl)-11-methyl-8-methylidene-3-oxo-4-bicyclo[7.2.0]undec-4-enyl]methyl acetate	292.40	1.4	1	4	63.6	4
BIMP031686	Bauhiniaside B	434.40	1.3	5	9	145.91	8
BIMP031687	Henriol A	734.70	-1.4	4	14	212.42	0
BIMP031688	[(1S,12R,17S)-17-hydroxy-12-methyl-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6,10-trien-17-yl]methyl octadecanoate	580.90	12.4	1	4	59.67	19
BIMP031689	Zerumbetol	300.40	5	1	2	33.37	2
BIMP031690	Ocotillol II	460.70	7.2	2	3	49.69	2
BIMP031691	alpha-Zeorin	444.70	8.5	2	2	40.46	1
BIMP031692	Lyoniol A	410.50	0.3	4	7	119.75	2
BIMP031693	N-3-Methoxybenzyl9Z,12Z,15Z-octadeca-9,12,15-trienamide	397.60	7.1	1	2	38.33	16
BIMP031694	Betulin 3-O-palmitate	681.10	16.2	1	3	46.53	18
BIMP031695	Sculponeatin B	360.40	1.2	1	6	82.06	0
BIMP031696	Adynerin gentiobioside	840.90	-0.6	7	17	245.05	10
BIMP031697	methyl 2-[(1S,3R,4S,7S,8R,11R,12R,13S)-2,12-dimethyl-9-oxo-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-3-yl]acetate	335.40	2.9	0	5	55.84	4
BIMP031698	Danielone	212.20	-0.4	2	5	75.99	4
BIMP031699	3-Butyl-4-methyl-furan-2(5h)-one	154.21	2	0	2	26.3	3
BIMP031700	6,10-Dimethylundecadien-2-one	194.31	4.3	0	1	17.07	6

BIMP031676

ent-11alpha-Hydroxy-15-oxokaur-16-en-19-oic acid

332.40

3.1

2

4

74.6

1

BIMP031677

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 11-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylate

494.60

1.3

5

9

153.75

4

BIMP031678

methyl (6R)-1,6-dimethyl-10,11-dioxo-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-6-carboxylate

338.40

3.2

0

5

73.58

2

BIMP031679

Methyl tanshinonate

338.40

3.2

0

5

73.58

2

BIMP031680

7-hydroxy-1,6,6-trimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione

310.30

3

1

4

67.51

0

BIMP031681

1-((E)-(S)-3,7-Dimethyl-3-vinyl-octa-1,6-dienyl)-4-methoxy-benzene

270.40

6.4

0

1

9.23

7

BIMP031682

1,3-Dimethyl-3-(4-methylpent-3-enyl)-2-oxabicyclo[2.2.2]octan-6-one

236.35

3.2

0

2

26.3

3

BIMP031683

2-[4-[Hydroxy-[5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

538.50

-0.5

7

12

187.76

9

BIMP031684

Aromadendrin 4'-glucoside

450.40

0

7

11

186.37

4

BIMP031685

[(1R,4Z,9S,11R)-11-(hydroxymethyl)-11-methyl-8-methylidene-3-oxo-4-bicyclo[7.2.0]undec-4-enyl]methyl acetate

292.40

1.4

1

4

63.6

4

BIMP031686

Bauhiniaside B

434.40

1.3

5

9

145.91

8

BIMP031687

Henriol A

734.70

-1.4

4

14

212.42

0

BIMP031688

[(1S,12R,17S)-17-hydroxy-12-methyl-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6,10-trien-17-yl]methyl octadecanoate

580.90

12.4

1

4

59.67

19

BIMP031689

Zerumbetol

300.40

5

1

2

33.37

2

BIMP031690

Ocotillol II

460.70

7.2

2

3

49.69

2

BIMP031691

alpha-Zeorin

444.70

8.5

2

40.46

1

BIMP031692

Lyoniol A

410.50

0.3

4

7

119.75

2

BIMP031693

N-3-Methoxybenzyl9Z,12Z,15Z-octadeca-9,12,15-trienamide

397.60

7.1

1

2

38.33

16

BIMP031694

Betulin 3-O-palmitate

681.10

16.2

1

3

46.53

18

BIMP031695

Sculponeatin B

360.40

1.2

1

6

82.06

0

BIMP031696

Adynerin gentiobioside

840.90

-0.6

7

17

245.05

10

BIMP031697

methyl 2-[(1S,3R,4S,7S,8R,11R,12R,13S)-2,12-dimethyl-9-oxo-13-propan-2-yl-10-oxa-2-azatetracyclo[5.4.1.18,11.04,12]tridecan-3-yl]acetate

335.40

2.9

0

5

55.84

4

BIMP031698

Danielone

212.20

-0.4

2

5

75.99

4

BIMP031699

3-Butyl-4-methyl-furan-2(5h)-one

154.21

2

0

2

26.3

3

BIMP031700

6,10-Dimethylundecadien-2-one

194.31

4.3

0

1

17.07

6