Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP011251	9-(2-Aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol	325.50	2.4	2	8	181.98	3
BIMP011252	1-(4-hydroxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-1-one	328.31	-1.1	5	8	136.68	6
BIMP011253	Exostemin	328.30	2.6	1	6	78.13	4
BIMP011254	(6R,8S)-henicosane-6,8-diol	328.60	8.3	2	2	40.46	18
BIMP011255	Glaucocalyxin A	332.40	1.7	2	4	74.6	0
BIMP011256	Suregadolide A	332.40	2.4	2	4	66.76	0
BIMP011257	[(2S,4R,5R,6S,7R)-7-hydroxy-6,10-dimethyl-8-oxo-2-prop-1-en-2-ylspiro[4.5]dec-9-en-4-yl] (E)-2-methylbut-2-enoate	332.40	3.7	1	4	63.6	4
BIMP011258	1-Tetracosanol	354.70	11.6	1	1	20.23	22
BIMP011259	2-Acetyl-3,5-dimethylpyrazine	150.18	0.6	0	3	42.85	1
BIMP011260	4-Methoxylonchocarpin	336.40	4.8	1	4	55.76	4
BIMP011261	Centcyamine, (Z)-	336.40	2.5	3	3	74.35	6
BIMP011262	2-Acetyl-3,6-dimethylpyrazine	150.18	0.6	0	3	42.85	1
BIMP011263	9-[(2S,3R,6E)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-2,6-dimethylnon-2-en-5-one	338.50	2.3	2	4	66.76	8
BIMP011264	Corylifol B	340.40	4.7	4	5	97.99	5
BIMP011265	Vavain	344.30	2.9	2	7	98.36	4
BIMP011266	(6aR,10aR)-4-hydroxy-7,7-dimethyl-6-oxo-3-propan-2-yl-6a,8,9,10-tetrahydrobenzo[c]chromene-1,10a-dicarbaldehyde	344.40	3.3	1	5	80.67	3
BIMP011267	(1R,2S,5S,8R,9R,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one	348.40	1.4	3	5	86.99	0
BIMP011268	Dimethylamine hydrochloride	81.54		2	1	12.03	0
BIMP011269	Licochalcone D	354.40	4.5	3	5	86.99	6
BIMP011270	(3S,6S)-3,6-bis[(4-hydroxyphenyl)methyl]-1,4-dimethylpiperazine-2,5-dione	354.40	2.3	2	4	81.08	4
BIMP011271	Romucosine C	355.40	2.9	1	5	68.23	3
BIMP011272	Negundin B	358.40	1.5	4	6	99.38	5
BIMP011273	2,9-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,3,11-triol	358.40	2.4	3	5	79.15	2
BIMP011274	Methyl (6aS)-3-chloro-4,5,6a,7-tetrahydro-2-hydroxy-1-methoxy-6H-dibenzo[de,g]quinoline-6-carboxylate	359.80	3.6	1	4	59	2
BIMP011275	14-Deoxy-12-methoxyandrographolide	364.50	2.7	2	5	75.99	5

BIMP011251

9-(2-Aminoethyl)-6-methoxy-1,2,3,4,5-benzopentathiepin-7-ol

325.50

2.4

2

8

181.98

3

BIMP011252

1-(4-hydroxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-1-one

328.31

-1.1

5

8

136.68

6

BIMP011253

Exostemin

328.30

2.6

1

6

78.13

4

BIMP011254

(6R,8S)-henicosane-6,8-diol

328.60

8.3

2

40.46

18

BIMP011255

Glaucocalyxin A

332.40

1.7

2

4

74.6

0

BIMP011256

Suregadolide A

332.40

2.4

2

4

66.76

0

BIMP011257

[(2S,4R,5R,6S,7R)-7-hydroxy-6,10-dimethyl-8-oxo-2-prop-1-en-2-ylspiro[4.5]dec-9-en-4-yl] (E)-2-methylbut-2-enoate

332.40

3.7

1

4

63.6

4

BIMP011258

1-Tetracosanol

354.70

11.6

1

20.23

22

BIMP011259

2-Acetyl-3,5-dimethylpyrazine

150.18

0.6

0

3

42.85

1

BIMP011260

4-Methoxylonchocarpin

336.40

4.8

1

4

55.76

4

BIMP011261

Centcyamine, (Z)-

336.40

2.5

3

74.35

6

BIMP011262

2-Acetyl-3,6-dimethylpyrazine

150.18

0.6

0

3

42.85

1

BIMP011263

9-[(2S,3R,6E)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-2,6-dimethylnon-2-en-5-one

338.50

2.3

2

4

66.76

8

BIMP011264

Corylifol B

340.40

4.7

4

5

97.99

5

BIMP011265

Vavain

344.30

2.9

2

7

98.36

4

BIMP011266

(6aR,10aR)-4-hydroxy-7,7-dimethyl-6-oxo-3-propan-2-yl-6a,8,9,10-tetrahydrobenzo[c]chromene-1,10a-dicarbaldehyde

344.40

3.3

1

5

80.67

3

BIMP011267

(1R,2S,5S,8R,9R,10S,11R,18R)-9,10,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one

348.40

1.4

3

5

86.99

0

BIMP011268

Dimethylamine hydrochloride

81.54

2

1

12.03

0

BIMP011269

Licochalcone D

354.40

4.5

3

5

86.99

6

BIMP011270

(3S,6S)-3,6-bis[(4-hydroxyphenyl)methyl]-1,4-dimethylpiperazine-2,5-dione

354.40

2.3

2

4

81.08

4

BIMP011271

Romucosine C

355.40

2.9

1

5

68.23

3

BIMP011272

Negundin B

358.40

1.5

4

6

99.38

5

BIMP011273

2,9-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,3,11-triol

358.40

2.4

3

5

79.15

2

BIMP011274

Methyl (6aS)-3-chloro-4,5,6a,7-tetrahydro-2-hydroxy-1-methoxy-6H-dibenzo[de,g]quinoline-6-carboxylate

359.80

3.6

1

4

59

2

BIMP011275

14-Deoxy-12-methoxyandrographolide

364.50

2.7

2

5

75.99

5