Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP000126	Carpesiolin	264.32	1.1	1	4	63.6	0
BIMP000127	Rotenone, dihydro-dihydroxy-	428.40	1.7	2	8	103.68	4
BIMP000128	5-Hydroxy-2-(hydroxymethyl)-7-methoxy-6-(methoxymethyl)chromen-4-one	266.25	0.5	2	6	89.13	4
BIMP000129	4-Methoxy-8-pentyl-1-naphthoic acid	272.34	5.1	1	3	46.53	6
BIMP000130	9-Hydroxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-1(18),2,4(8),9,13,15(19),16-heptaen-11-one	279.25	3.3	1	4	60.17	0
BIMP000131	Phenol, 2-[3-hydroxy-4-(2-propenyl)phenoxy]-5-(2-propenyl)-	282.30	4.9	2	3	49.69	6
BIMP000132	Muricatacin	284.40	5.8	1	3	46.53	12
BIMP000133	Citrusinine II	287.27	2.6	3	6	91.92	1
BIMP000134	cespitularin C	288.50	4.3	1	1	20.23	0
BIMP000135	6,6,12-Trimethylisochromeno[4,3-c]quinolin-11-one	291.30	3	0	2	31.23	0
BIMP000136	N-(2,3-Dihydroxy-1,10-dimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide	371.40	0.2	3	6	105.09	3
BIMP000137	1,2-Didemethylcolchicine	371.40	0.2	3	6	105.09	3
BIMP000138	Acetamide, N-(6,7,8,10-tetrahydro-4,11-dimethoxy-10-oxoheptaleno(1,2-e)-1,3-benzodioxol-8-yl)-, (S)-	383.40	1.8	1	6	83.09	3
BIMP000139	(1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid	300.40	5.6	1	2	37.3	2
BIMP000140	Luotonin B	301.30	2.2	1	4	68.01	0
BIMP000141	Amarbellisine	301.34	1.1	1	5	51.16	1
BIMP000142	(1S,3aR,4R,8aS)-4-hydroxy-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1-sulfonic acid	302.40	1.7	2	4	82.98	2
BIMP000143	Neodulin	308.30	3.2	0	5	50.06	0
BIMP000144	4-(4'-O-Acetyl-alpha-L-rhamnosyloxy)benzaldehyde	310.30	0.3	2	7	102.29	5
BIMP000145	(4S,4aS,5R,6S,8aR,9aR)-6-hydroxy-4,9a-dimethoxy-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-2-one	310.40	1.3	1	5	64.99	2
BIMP000146	Spiranthol A	310.40	5	2	3	49.69	3
BIMP000147	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2S)-2-phenylpropanoate	312.31	0.2	4	7	116.45	5
BIMP000148	8-Formyl-2,5,7-trihydroxy-6-methylflavanone	314.29	2.4	3	6	104.06	2
BIMP000149	12-Hydroxy-7-oxo-8,11,13-abietatrien-18-al	314.40	4.1	1	3	54.37	2
BIMP000150	1,4a-Dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid	314.40	4.5	1	3	54.37	2

BIMP000126

Carpesiolin

264.32

1.1

1

4

63.6

0

BIMP000127

Rotenone, dihydro-dihydroxy-

428.40

1.7

2

8

103.68

4

BIMP000128

5-Hydroxy-2-(hydroxymethyl)-7-methoxy-6-(methoxymethyl)chromen-4-one

266.25

0.5

2

6

89.13

4

BIMP000129

4-Methoxy-8-pentyl-1-naphthoic acid

272.34

5.1

1

3

46.53

6

BIMP000130

9-Hydroxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-1(18),2,4(8),9,13,15(19),16-heptaen-11-one

279.25

3.3

1

4

60.17

0

BIMP000131

Phenol, 2-[3-hydroxy-4-(2-propenyl)phenoxy]-5-(2-propenyl)-

282.30

4.9

2

3

49.69

6

BIMP000132

Muricatacin

284.40

5.8

1

3

46.53

12

BIMP000133

Citrusinine II

287.27

2.6

3

6

91.92

1

BIMP000134

cespitularin C

288.50

4.3

1

20.23

0

BIMP000135

6,6,12-Trimethylisochromeno[4,3-c]quinolin-11-one

291.30

3

0

2

31.23

0

BIMP000136

N-(2,3-Dihydroxy-1,10-dimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide

371.40

0.2

3

6

105.09

3

BIMP000137

1,2-Didemethylcolchicine

371.40

0.2

3

6

105.09

3

BIMP000138

Acetamide, N-(6,7,8,10-tetrahydro-4,11-dimethoxy-10-oxoheptaleno(1,2-e)-1,3-benzodioxol-8-yl)-, (S)-

383.40

1.8

1

6

83.09

3

BIMP000139

(1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid

300.40

5.6

1

2

37.3

2

BIMP000140

Luotonin B

301.30

2.2

1

4

68.01

0

BIMP000141

Amarbellisine

301.34

1.1

1

5

51.16

1

BIMP000142

(1S,3aR,4R,8aS)-4-hydroxy-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1-sulfonic acid

302.40

1.7

2

4

82.98

2

BIMP000143

Neodulin

308.30

3.2

0

5

50.06

0

BIMP000144

4-(4'-O-Acetyl-alpha-L-rhamnosyloxy)benzaldehyde

310.30

0.3

2

7

102.29

5

BIMP000145

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

310.40

1.3

1

5

64.99

2

BIMP000146

Spiranthol A

310.40

5

2

3

49.69

3

BIMP000147

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2S)-2-phenylpropanoate

312.31

0.2

4

7

116.45

5

BIMP000148

8-Formyl-2,5,7-trihydroxy-6-methylflavanone

314.29

2.4

3

6

104.06

2

BIMP000149

12-Hydroxy-7-oxo-8,11,13-abietatrien-18-al

314.40

4.1

1

3

54.37

2

BIMP000150

1,4a-Dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid

314.40

4.5

1

3

54.37

2