Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP032451	[(E)-5-[(1S,4aR,5S,8aR)-5-formyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enyl] acetate	346.50	5.1	0	3	43.37	7
BIMP032452	Dryopterin	330.29	1	4	7	116.45	1
BIMP032453	3,5-Heptanediol, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate	460.50	4.4	2	8	111.52	14
BIMP032454	[4-[(3S,5S)-3,5-diacetyloxy-7-(4-acetyloxy-3-methoxyphenyl)heptyl]-2-methoxyphenyl] acetate	544.60	4.6	0	10	123.66	18
BIMP032455	(3aS,5aR,9S,9aS,9bS)-9-hydroxy-5a,9-dimethyl-3-methylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one	250.33	2.8	1	3	46.53	0
BIMP032456	1,2-Dimethoxy-3-(10-phenyldecyl)benzene	354.50	8.4	0	2	18.46	13
BIMP032457	1,2-Dimethoxy-3-(12-phenyldodecyl)benzene	382.60	9.5	0	2	18.46	15
BIMP032458	10-Hydroxyaloin	434.40	-1.2	8	10	188.14	3
BIMP032459	10-Hydroxyaloin A	434.40	-1.2	8	10	188.14	3
BIMP032460	10-Hydroxyaloin B	434.40	-1.2	8	10	188.14	3
BIMP032461	methyl (1S,4aR,5S,8aR)-5-[(E)-5-acetyloxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate	376.50	5.5	0	4	52.6	8
BIMP032462	Piperenol A	384.40	1.1	3	7	113.29	7
BIMP032463	[(3R,4S,5R,6S)-5-benzoyloxy-3,4,6-trihydroxycyclohexen-1-yl]methyl benzoate	384.40	1.1	3	7	113.29	7
BIMP032464	Piperenol A triacetate	510.50	2.8	0	10	131.5	13
BIMP032465	[(3R,4S,5R,6S)-3,4,6-triacetyloxy-5-benzoyloxycyclohexen-1-yl]methyl benzoate	510.50	2.8	0	10	131.5	13
BIMP032466	Piperenol B	384.40	1.5	3	7	113.29	7
BIMP032467	[(1S,4R,5S,6S)-4-benzoyloxy-1,5,6-trihydroxycyclohex-2-en-1-yl]methyl benzoate	384.40	1.5	3	7	113.29	7
BIMP032468	(1S,2S,7R,9R,17R)-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,12,14-triene-3,11,16-trione	372.40	2	0	6	78.9	2
BIMP032469	5-Hydroxy-6-methoxybenzo[f][1]benzofuran-4,9-dione	244.20	2.4	1	5	76.74	1
BIMP032470	8-Hydroxy-7-methoxybenzo[f][1]benzofuran-4,9-dione	244.20	2.4	1	5	76.74	1
BIMP032471	8-Hydroxy-6-methoxybenzo[f][1]benzofuran-4,9-dione	244.20	2.4	1	5	76.74	1
BIMP032472	5-Hydroxy-7-methoxybenzo[f][1]benzofuran-4,9-dione	244.20	2.4	1	5	76.74	1
BIMP032473	6,13-Dihydroxy-5-methoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4(16),5,7,9,11,13-heptaen-3-one	282.25	3.2	2	5	79.9	1
BIMP032474	Isooxoflaccidin	284.26	2.6	2	5	79.9	1
BIMP032475	[Gallocatechin-(4alpha->8)]2-catechin	898.80	2.6	17	20	371.6	5

BIMP032451

[(E)-5-[(1S,4aR,5S,8aR)-5-formyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enyl] acetate

346.50

5.1

0

3

43.37

7

BIMP032452

Dryopterin

330.29

1

4

7

116.45

1

BIMP032453

3,5-Heptanediol, 1,7-bis(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate

460.50

4.4

2

8

111.52

14

BIMP032454

[4-[(3S,5S)-3,5-diacetyloxy-7-(4-acetyloxy-3-methoxyphenyl)heptyl]-2-methoxyphenyl] acetate

544.60

4.6

0

10

123.66

18

BIMP032455

(3aS,5aR,9S,9aS,9bS)-9-hydroxy-5a,9-dimethyl-3-methylidene-3a,4,5,6,7,8,9a,9b-octahydrobenzo[g][1]benzofuran-2-one

250.33

2.8

1

3

46.53

0

BIMP032456

1,2-Dimethoxy-3-(10-phenyldecyl)benzene

354.50

8.4

0

2

18.46

13

BIMP032457

1,2-Dimethoxy-3-(12-phenyldodecyl)benzene

382.60

9.5

0

2

18.46

15

BIMP032458

10-Hydroxyaloin

434.40

-1.2

8

10

188.14

3

BIMP032459

10-Hydroxyaloin A

434.40

-1.2

8

10

188.14

3

BIMP032460

10-Hydroxyaloin B

434.40

-1.2

8

10

188.14

3

BIMP032461

methyl (1S,4aR,5S,8aR)-5-[(E)-5-acetyloxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate

376.50

5.5

0

4

52.6

8

BIMP032462

Piperenol A

384.40

1.1

3

7

113.29

7

BIMP032463

[(3R,4S,5R,6S)-5-benzoyloxy-3,4,6-trihydroxycyclohexen-1-yl]methyl benzoate

384.40

1.1

3

7

113.29

7

BIMP032464

Piperenol A triacetate

510.50

2.8

0

10

131.5

13

BIMP032465

[(3R,4S,5R,6S)-3,4,6-triacetyloxy-5-benzoyloxycyclohexen-1-yl]methyl benzoate

510.50

2.8

0

10

131.5

13

BIMP032466

Piperenol B

384.40

1.5

3

7

113.29

7

BIMP032467

[(1S,4R,5S,6S)-4-benzoyloxy-1,5,6-trihydroxycyclohex-2-en-1-yl]methyl benzoate

384.40

1.5

3

7

113.29

7

BIMP032468

(1S,2S,7R,9R,17R)-4,15-dimethoxy-2,14,17-trimethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,12,14-triene-3,11,16-trione

372.40

2

0

6

78.9

2

BIMP032469

5-Hydroxy-6-methoxybenzo[f][1]benzofuran-4,9-dione

244.20

2.4

1

5

76.74

1

BIMP032470

8-Hydroxy-7-methoxybenzo[f][1]benzofuran-4,9-dione

244.20

2.4

1

5

76.74

1

BIMP032471

8-Hydroxy-6-methoxybenzo[f][1]benzofuran-4,9-dione

244.20

2.4

1

5

76.74

1

BIMP032472

5-Hydroxy-7-methoxybenzo[f][1]benzofuran-4,9-dione

244.20

2.4

1

5

76.74

1

BIMP032473

6,13-Dihydroxy-5-methoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4(16),5,7,9,11,13-heptaen-3-one

282.25

3.2

2

5

79.9

1

BIMP032474

Isooxoflaccidin

284.26

2.6

2

5

79.9

1

BIMP032475

[Gallocatechin-(4alpha->8)]2-catechin

898.80

2.6

17

20

371.6

5