Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP011076	methyl (1S,4S,5S,6S,8S,11Z,14S)-11-ethylidene-6-hydroxy-12-oxo-7,9,13-trioxatetracyclo[6.5.1.01,10.04,14]tetradec-2-ene-5-carboxylate	308.28	0.5	1	7	91.29	2
BIMP011077	Methionol	106.19	0.5	1	2	45.53	3
BIMP011078	(4S)-6,7-dibromo-4-hydroxy-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-1-one	309.94	1.1	2	2	54.26	0
BIMP011079	(2E,6S)-2,6-dimethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyocta-2,7-dienoic acid	316.35	-0.1	4	7	116.45	7
BIMP011080	9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic Acid	316.40	4.3	2	3	57.53	2
BIMP011081	Hex-2-enyl butyrate	170.25	2.8	0	2	26.3	7
BIMP011082	(11R,13R,15S,18R)-15-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraene-11,18-diol	317.34	0.7	2	6	71.39	1
BIMP011083	methyl (13Z,14S,16S,18S)-13-ethylidene-1,11-diazapentacyclo[12.3.1.02,7.08,17.011,16]octadeca-2,4,6,8(17)-tetraene-18-carboxylate	322.40	2.5	0	3	34.47	2
BIMP011084	Epiquinine	324.40	2.9	1	4	45.59	4
BIMP011085	clausamine C	325.40	3.2	2	4	71.55	2
BIMP011086	3-Galloylshikimic acid	326.25	-0.6	6	9	164.75	4
BIMP011087	1,5-Dihydroxy-3-methoxy-2-prenylxanthone	326.30	4.7	2	5	79.9	3
BIMP011088	1-(4-Hydroxy-3-methoxyphenyl)-7-phenylheptane-3,5-diol	330.40	2.9	3	4	69.92	9
BIMP011089	Carpachromene	336.30	3.9	2	5	79.9	1
BIMP011090	Marrubenol	336.50	3	3	4	73.83	4
BIMP011091	1,4-Diaminobutane	88.15	-0.9	2	2	52.04	3
BIMP011092	clauslactone E	342.30	3.5	1	6	85.97	5
BIMP011093	4-[(2R,3R,4S,5S)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol	342.40	3.9	1	5	57.15	3
BIMP011094	[(3aR,4S,6R,6aR,9aR,9bR)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] (Z)-2-methylbut-2-enoate	346.40	2.6	1	5	72.83	3
BIMP011095	[(3aR,4S,6R,6aR,9aR,9bR)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] (E)-2-methylbut-2-enoate	346.40	2.6	1	5	72.83	3
BIMP011096	2-[6-(1,3-benzodioxol-5-yl)hexyl]-1H-quinolin-4-one	349.40	5.6	1	4	51.32	7
BIMP011097	Isoartocarpesin	354.40	3.2	4	6	111.13	3
BIMP011098	alpha,beta-Dihydroxanthohumol	356.40	4.9	3	5	86.99	7
BIMP011099	machilin G	356.40	4.3	0	5	46.15	4
BIMP011100	1,3-Dithiane	120.20	1.8	0	2	50.6	0

BIMP011076

methyl (1S,4S,5S,6S,8S,11Z,14S)-11-ethylidene-6-hydroxy-12-oxo-7,9,13-trioxatetracyclo[6.5.1.01,10.04,14]tetradec-2-ene-5-carboxylate

308.28

0.5

1

7

91.29

2

BIMP011077

Methionol

106.19

0.5

1

2

45.53

3

BIMP011078

(4S)-6,7-dibromo-4-hydroxy-3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-1-one

309.94

1.1

2

54.26

0

BIMP011079

(2E,6S)-2,6-dimethyl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyocta-2,7-dienoic acid

316.35

-0.1

4

7

116.45

7

BIMP011080

9-hydroxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic Acid

316.40

4.3

2

3

57.53

2

BIMP011081

Hex-2-enyl butyrate

170.25

2.8

0

2

26.3

7

BIMP011082

(11R,13R,15S,18R)-15-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9,16-tetraene-11,18-diol

317.34

0.7

2

6

71.39

1

BIMP011083

methyl (13Z,14S,16S,18S)-13-ethylidene-1,11-diazapentacyclo[12.3.1.02,7.08,17.011,16]octadeca-2,4,6,8(17)-tetraene-18-carboxylate

322.40

2.5

0

3

34.47

2

BIMP011084

Epiquinine

324.40

2.9

1

4

45.59

4

BIMP011085

clausamine C

325.40

3.2

2

4

71.55

2

BIMP011086

3-Galloylshikimic acid

326.25

-0.6

6

9

164.75

4

BIMP011087

1,5-Dihydroxy-3-methoxy-2-prenylxanthone

326.30

4.7

2

5

79.9

3

BIMP011088

1-(4-Hydroxy-3-methoxyphenyl)-7-phenylheptane-3,5-diol

330.40

2.9

3

4

69.92

9

BIMP011089

Carpachromene

336.30

3.9

2

5

79.9

1

BIMP011090

Marrubenol

336.50

3

4

73.83

4

BIMP011091

1,4-Diaminobutane

88.15

-0.9

2

52.04

3

BIMP011092

clauslactone E

342.30

3.5

1

6

85.97

5

BIMP011093

4-[(2R,3R,4S,5S)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2-methoxyphenol

342.40

3.9

1

5

57.15

3

BIMP011094

[(3aR,4S,6R,6aR,9aR,9bR)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] (Z)-2-methylbut-2-enoate

346.40

2.6

1

5

72.83

3

BIMP011095

[(3aR,4S,6R,6aR,9aR,9bR)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl] (E)-2-methylbut-2-enoate

346.40

2.6

1

5

72.83

3

BIMP011096

2-[6-(1,3-benzodioxol-5-yl)hexyl]-1H-quinolin-4-one

349.40

5.6

1

4

51.32

7

BIMP011097

Isoartocarpesin

354.40

3.2

4

6

111.13

3

BIMP011098

alpha,beta-Dihydroxanthohumol

356.40

4.9

3

5

86.99

7

BIMP011099

machilin G

356.40

4.3

0

5

46.15

4

BIMP011100

1,3-Dithiane

120.20

1.8

0

2

50.6

0