Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP011501	(1S,2R,7S,9S,10R,12S)-2,7-dihydroxy-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.03,7.010,12]tridec-3-en-5-one	262.30	0.3	2	4	66.76	0
BIMP011502	Sinalbin B	264.40	3.6	0	4	77.12	2
BIMP011503	2-[(2R,4aR,5R,7R,8R)-5,7-dihydroxy-4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl]prop-2-enoic acid	266.33	1.6	3	4	77.76	2
BIMP011504	4H-1-Benzopyran-4-one, 3,7,8-trihydroxy-2-phenyl-	270.24	2.3	3	5	90.9	1
BIMP011505	(4S,4aS,5R,6S,8aR,9aS)-6-hydroxy-4-methoxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one	280.36	1.6	1	4	55.76	1
BIMP011506	4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol	287.35	2.5	2	4	50.72	7
BIMP011507	(2S,4aR,6R,7S,8S,8aR)-6-(hydroxymethyl)-2-(methylsulfonylmethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol	298.31	-2.3	3	8	130.9	3
BIMP011508	Acalycixeniolide C	302.40	2.8	0	3	38.83	3
BIMP011509	Annosquamosin B	308.50	2.7	3	3	60.69	1
BIMP011510	Lansamide 4	311.40	2.4	1	3	49.77	3
BIMP011511	4-[(E,3S,5S)-3-hydroxy-5-methoxy-7-phenylhept-6-enyl]phenol	312.40	3.9	2	3	49.69	8
BIMP011512	phytocassane E	316.40	3	1	3	54.37	1
BIMP011513	Pyridoxamine	168.19	-1	3	4	79.37	2
BIMP011514	(3R,3aR,4S,6R,6aS,9S,9aS,9bS)-6a-hydroperoxy-4,6,9-trihydroxy-3-(hydroxymethyl)-6,9-dimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2-one	330.33	-1.1	5	8	136.68	2
BIMP011515	CID 10521953	352.50	2.6	2	5	75.99	0
BIMP011516	Dihydrozeatin riboside	353.37	0.1	5	9	145.78	7
BIMP011517	Micromarin A	358.40	3.2	0	6	78.27	8
BIMP011518	methyl (2E,6S)-2-(hydroxymethyl)-6-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyocta-2,7-dienoate	360.40	-0.6	4	8	125.68	9
BIMP011519	methyl (8R)-8-ethyl-6-oxo-7-oxa-10,20-diazapentacyclo[11.7.0.02,10.04,8.014,19]icosa-1(13),2,4,14,16,18-hexaene-5-carboxylate	364.40	2.8	1	5	71.63	3
BIMP011520	1-[(6S,8R,11R,12S,16S)-7,7,12,16-tetramethyl-6-(methylamino)-15-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),3,14-trienyl]ethanone	367.60	4.7	1	2	29.1	2
BIMP011521	3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]-2H-furan-5-one	368.40	3.4	0	6	63.22	6
BIMP011522	1,3-benzodioxol-5-yl-[(3R,4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]methanone	370.40	1.9	1	7	83.45	4
BIMP011523	methyl (6aR,7R,8R,10aS)-7-[2-(furan-3-yl)-2-oxoethyl]-7-methyl-3-oxo-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-8-carboxylate	372.40	2.7	0	6	82.81	5
BIMP011524	1-Hydroxy-10-methyl-4,4-bis(3-methylbut-2-enyl)acridine-3,9-dione	377.50	5.4	1	4	59.3	4
BIMP011525	[(4S,4aR,5R,6S,8aS,9R,9aR)-6,9,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-4-yl] (Z)-2-methylbut-2-enoate	380.40	1.1	3	7	113.29	3

BIMP011501

(1S,2R,7S,9S,10R,12S)-2,7-dihydroxy-4,9-dimethyl-13-methylidene-6-oxatetracyclo[7.4.0.03,7.010,12]tridec-3-en-5-one

262.30

0.3

2

4

66.76

0

BIMP011502

Sinalbin B

264.40

3.6

0

4

77.12

2

BIMP011503

2-[(2R,4aR,5R,7R,8R)-5,7-dihydroxy-4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl]prop-2-enoic acid

266.33

1.6

3

4

77.76

2

BIMP011504

4H-1-Benzopyran-4-one, 3,7,8-trihydroxy-2-phenyl-

270.24

2.3

3

5

90.9

1

BIMP011505

(4S,4aS,5R,6S,8aR,9aS)-6-hydroxy-4-methoxy-3,4a,5-trimethyl-4,5,6,7,8,8a,9,9a-octahydrobenzo[f][1]benzofuran-2-one

280.36

1.6

1

4

55.76

1

BIMP011506

4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

287.35

2.5

2

4

50.72

7

BIMP011507

(2S,4aR,6R,7S,8S,8aR)-6-(hydroxymethyl)-2-(methylsulfonylmethyl)-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxine-7,8-diol

298.31

-2.3

3

8

130.9

3

BIMP011508

Acalycixeniolide C

302.40

2.8

0

3

38.83

3

BIMP011509

Annosquamosin B

308.50

2.7

3

60.69

1

BIMP011510

Lansamide 4

311.40

2.4

1

3

49.77

3

BIMP011511

4-[(E,3S,5S)-3-hydroxy-5-methoxy-7-phenylhept-6-enyl]phenol

312.40

3.9

2

3

49.69

8

BIMP011512

phytocassane E

316.40

3

1

3

54.37

1

BIMP011513

Pyridoxamine

168.19

-1

3

4

79.37

2

BIMP011514

(3R,3aR,4S,6R,6aS,9S,9aS,9bS)-6a-hydroperoxy-4,6,9-trihydroxy-3-(hydroxymethyl)-6,9-dimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2-one

330.33

-1.1

5

8

136.68

2

BIMP011515

CID 10521953

352.50

2.6

2

5

75.99

0

BIMP011516

Dihydrozeatin riboside

353.37

0.1

5

9

145.78

7

BIMP011517

Micromarin A

358.40

3.2

0

6

78.27

8

BIMP011518

methyl (2E,6S)-2-(hydroxymethyl)-6-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyocta-2,7-dienoate

360.40

-0.6

4

8

125.68

9

BIMP011519

methyl (8R)-8-ethyl-6-oxo-7-oxa-10,20-diazapentacyclo[11.7.0.02,10.04,8.014,19]icosa-1(13),2,4,14,16,18-hexaene-5-carboxylate

364.40

2.8

1

5

71.63

3

BIMP011520

1-[(6S,8R,11R,12S,16S)-7,7,12,16-tetramethyl-6-(methylamino)-15-tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),3,14-trienyl]ethanone

367.60

4.7

1

2

29.1

2

BIMP011521

3-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-dimethoxyphenyl)methyl]-2H-furan-5-one

368.40

3.4

0

6

63.22

6

BIMP011522

1,3-benzodioxol-5-yl-[(3R,4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(hydroxymethyl)oxolan-3-yl]methanone

370.40

1.9

1

7

83.45

4

BIMP011523

methyl (6aR,7R,8R,10aS)-7-[2-(furan-3-yl)-2-oxoethyl]-7-methyl-3-oxo-5,6,6a,8,9,10-hexahydro-1H-benzo[d][2]benzofuran-8-carboxylate

372.40

2.7

0

6

82.81

5

BIMP011524

1-Hydroxy-10-methyl-4,4-bis(3-methylbut-2-enyl)acridine-3,9-dione

377.50

5.4

1

4

59.3

4

BIMP011525

[(4S,4aR,5R,6S,8aS,9R,9aR)-6,9,9a-trihydroxy-3,4a,5-trimethyl-2-oxo-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-4-yl] (Z)-2-methylbut-2-enoate

380.40

1.1

3

7

113.29

3