Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP012876	Callypentayne	272.40	6.1	0	0	0	9
BIMP012877	Orijanone	273.33	1.9	0	3	48.3	4
BIMP012878	5,7-Dioxa-13-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,15,17-pentaen-14-one	281.30	1.9	0	3	38.77	0
BIMP012879	(1S,5R,7S,8R,12R)-7,12-dihydroxy-1,5-dimethyl-8-propan-2-yl-9,10-dioxatricyclo[6.2.2.02,6]dodec-2(6)-en-3-one	282.33	0	2	5	75.99	1
BIMP012880	Saikosaponin D	781.00	2.5	8	13	207.99	6
BIMP012881	Dihydromollugin	286.32	4.2	1	4	55.76	2
BIMP012882	(4S)-4,9-dihydroxy-6-(hydroxymethyl)-8-methoxy-3,4-dihydro-2H-anthracen-1-one	288.29	1.4	3	5	86.99	2
BIMP012883	Megistonine II	293.27	1.6	1	7	86.99	4
BIMP012884	Desacetylplectranthone	294.40	1.7	1	4	63.6	4
BIMP012885	3-Hydroxypentanoic acid	118.13	0	2	3	57.53	3
BIMP012886	(4S,4aS,5R,6S,8aR,9aR)-6,9a-dihydroxy-4-methoxy-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-2-one	296.36	0.8	2	5	75.99	1
BIMP012887	(3S,7R)-5,6-dehydro-de-O-methyl-centrolobine	296.40	4.1	2	3	49.69	4
BIMP012888	Mollugin methyl ether	298.30	3.9	0	4	44.76	3
BIMP012889	5-Methylflavasperone	300.30	3.1	0	5	57.9	3
BIMP012890	(1S,2S,3S)-1,2-bis(4-methoxyphenyl)butane-1,3-diol	302.40	2.5	2	4	58.92	6
BIMP012891	Merilactone	304.40	3.9	0	3	43.37	2
BIMP012892	Hypotaurine	109.15	-1.5	2	4	82.53	2
BIMP012893	(12R,14R)-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaene-4,12,14-triol	314.40	3.3	3	4	69.92	0
BIMP012894	(+)-Zerumin A	318.40	4.5	1	3	54.37	5
BIMP012895	(1S,2S)-1,6-dihydroxy-2-(2-hydroxypropan-2-yl)-2,7-dihydro-1H-pyrano[3,4-c]carbazol-4-one	327.30	2.4	4	5	102.78	1
BIMP012896	7-Hydroxy-5,6,4'-trimethoxyisoflavone	328.30	2.7	1	6	78.13	4
BIMP012897	(4aS,10aR,11aR,11bS)-2-hydroxy-4,4,8,11b-tetramethyl-4a,5,6,10a,11,11a-hexahydronaphtho[2,1-f][1]benzofuran-3,9-dione	328.40	3	1	4	63.6	0
BIMP012898	(2R,3R,5S,6S)-2,5-bis(4-methoxyphenyl)-3,6-dimethyl-1,4-dioxane	328.40	3.6	0	4	36.92	4
BIMP012899	[(1E,3aR,5R,7S,7aS)-1-ethylidene-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate	330.50	4.5	0	3	43.37	5
BIMP012900	1,8-dihydroxy-3-[(E)-4-hydroxy-3-methylbut-2-enoxy]-6-methylanthracene-9,10-dione	354.40	3.3	3	6	104.06	4

BIMP012876

Callypentayne

272.40

6.1

0

9

BIMP012877

Orijanone

273.33

1.9

0

3

48.3

4

BIMP012878

5,7-Dioxa-13-azapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,15,17-pentaen-14-one

281.30

1.9

0

3

38.77

0

BIMP012879

(1S,5R,7S,8R,12R)-7,12-dihydroxy-1,5-dimethyl-8-propan-2-yl-9,10-dioxatricyclo[6.2.2.02,6]dodec-2(6)-en-3-one

282.33

0

2

5

75.99

1

BIMP012880

Saikosaponin D

781.00

2.5

8

13

207.99

6

BIMP012881

Dihydromollugin

286.32

4.2

1

4

55.76

2

BIMP012882

(4S)-4,9-dihydroxy-6-(hydroxymethyl)-8-methoxy-3,4-dihydro-2H-anthracen-1-one

288.29

1.4

3

5

86.99

2

BIMP012883

Megistonine II

293.27

1.6

1

7

86.99

4

BIMP012884

Desacetylplectranthone

294.40

1.7

1

4

63.6

4

BIMP012885

3-Hydroxypentanoic acid

118.13

0

2

3

57.53

3

BIMP012886

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

296.36

0.8

2

5

75.99

1

BIMP012887

(3S,7R)-5,6-dehydro-de-O-methyl-centrolobine

296.40

4.1

2

3

49.69

4

BIMP012888

Mollugin methyl ether

298.30

3.9

0

4

44.76

3

BIMP012889

5-Methylflavasperone

300.30

3.1

0

5

57.9

3

BIMP012890

(1S,2S,3S)-1,2-bis(4-methoxyphenyl)butane-1,3-diol

302.40

2.5

2

4

58.92

6

BIMP012891

Merilactone

304.40

3.9

0

3

43.37

2

BIMP012892

Hypotaurine

109.15

-1.5

2

4

82.53

2

BIMP012893

(12R,14R)-2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaene-4,12,14-triol

314.40

3.3

3

4

69.92

0

BIMP012894

(+)-Zerumin A

318.40

4.5

1

3

54.37

5

BIMP012895

(1S,2S)-1,6-dihydroxy-2-(2-hydroxypropan-2-yl)-2,7-dihydro-1H-pyrano[3,4-c]carbazol-4-one

327.30

2.4

4

5

102.78

1

BIMP012896

7-Hydroxy-5,6,4'-trimethoxyisoflavone

328.30

2.7

1

6

78.13

4

BIMP012897

(4aS,10aR,11aR,11bS)-2-hydroxy-4,4,8,11b-tetramethyl-4a,5,6,10a,11,11a-hexahydronaphtho[2,1-f][1]benzofuran-3,9-dione

328.40

3

1

4

63.6

0

BIMP012898

(2R,3R,5S,6S)-2,5-bis(4-methoxyphenyl)-3,6-dimethyl-1,4-dioxane

328.40

3.6

0

4

36.92

4

BIMP012899

[(1E,3aR,5R,7S,7aS)-1-ethylidene-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate

330.50

4.5

0

3

43.37

5

BIMP012900

1,8-dihydroxy-3-[(E)-4-hydroxy-3-methylbut-2-enoxy]-6-methylanthracene-9,10-dione

354.40

3.3

3

6

104.06

4