Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP034326	(Z)-p-Methoxycinnamic acid	178.18	1.8	1	3	46.53	3
BIMP034327	6-Prenylnaringenin	340.40	4.3	3	5	86.99	3
BIMP034328	Aguerin B	330.40	1.9	1	5	72.83	3
BIMP034329	Pentanoic acid, 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-, (hexahydro-1H-pyrrolizin-1-yl)methyl ester	299.41	1.7	2	5	70	7
BIMP034330	Ambiguine	523.70	0.4	2	9	106.92	9
BIMP034331	1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydrochloride	163.60		3	3	49.33	1
BIMP034332	Tetrahydrorhombifoline	248.36	1.8	0	2	23.55	3
BIMP034333	[(1S,8R,9S,12R)-4-acetyloxy-12-formyl-1,11,11-trimethyl-10-oxo-5-propan-2-yl-8-tricyclo[7.3.1.02,7]trideca-2,4,6-trienyl] acetate	414.50	3.1	0	6	86.74	6
BIMP034334	2-Chloro-5,8-dihydroxy-3-(3-methyl-2-butenyl)-1,4-naphthalenedione, 9CI	292.71	4.6	2	4	74.6	2
BIMP034335	3,5,5',6,7,8-Hexamethoxy-3',4'-methylenedioxyflavone	446.40	3	0	10	104.05	7
BIMP034336	(2E,2'E)-N,N'-butane-1,4-diylbis(3-phenylprop-2-enamide)	348.40	3.7	2	2	58.2	9
BIMP034337	(1R)-4-(hydroxymethyl)-1-propan-2-ylcyclohex-3-en-1-ol	170.25	0.9	2	2	40.46	2
BIMP034338	Koetjapic acid	470.70	7.5	2	4	74.6	5
BIMP034339	12beta-Hydroxyresibufogenin	400.50	2.6	2	5	83.2	1
BIMP034340	19-Hydroxydesacetylcinobufagin	416.50	1.5	3	6	103.43	2
BIMP034341	Desacetylcinobufotalin	416.50	1.5	3	6	103.43	1
BIMP034342	6-Methyl-1,2,3,4-tetrahydronaphthalene	146.23	3.7	0	0	0	0
BIMP034343	(2Z,6Z)-Farnesyl acetate	264.40	5.3	0	2	26.3	9
BIMP034344	Racemosin	288.29	2.8	0	5	57.9	2
BIMP034345	(2Z,6E)-Farnesyl acetate	264.40	5.3	0	2	26.3	9
BIMP034346	(2E,6Z)-farnesol acetate	264.40	5.3	0	2	26.3	9
BIMP034347	Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, ((1R,7aS)-hexahydro-1H-pyrrolizin-1-yl)methyl ester, (2R,3S)-	285.38	1.4	2	5	70	6
BIMP034348	Coromandaline	285.38	1.4	2	5	70	6
BIMP034349	Actaeaepoxide-3-o-beta-D-xylopyranoside	676.80	2.2	5	11	167.67	5
BIMP034350	Jujubogenin	472.70	6.3	2	4	58.92	1

BIMP034326

(Z)-p-Methoxycinnamic acid

178.18

1.8

1

3

46.53

3

BIMP034327

6-Prenylnaringenin

340.40

4.3

3

5

86.99

3

BIMP034328

Aguerin B

330.40

1.9

1

5

72.83

3

BIMP034329

Pentanoic acid, 2-hydroxy-2-(1-hydroxyethyl)-3-methyl-, (hexahydro-1H-pyrrolizin-1-yl)methyl ester

299.41

1.7

2

5

70

7

BIMP034330

Ambiguine

523.70

0.4

2

9

106.92

9

BIMP034331

1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydrochloride

163.60

3

49.33

1

BIMP034332

Tetrahydrorhombifoline

248.36

1.8

0

2

23.55

3

BIMP034333

[(1S,8R,9S,12R)-4-acetyloxy-12-formyl-1,11,11-trimethyl-10-oxo-5-propan-2-yl-8-tricyclo[7.3.1.02,7]trideca-2,4,6-trienyl] acetate

414.50

3.1

0

6

86.74

6

BIMP034334

2-Chloro-5,8-dihydroxy-3-(3-methyl-2-butenyl)-1,4-naphthalenedione, 9CI

292.71

4.6

2

4

74.6

2

BIMP034335

3,5,5',6,7,8-Hexamethoxy-3',4'-methylenedioxyflavone

446.40

3

0

10

104.05

7

BIMP034336

(2E,2'E)-N,N'-butane-1,4-diylbis(3-phenylprop-2-enamide)

348.40

3.7

2

58.2

9

BIMP034337

(1R)-4-(hydroxymethyl)-1-propan-2-ylcyclohex-3-en-1-ol

170.25

0.9

2

40.46

2

BIMP034338

Koetjapic acid

470.70

7.5

2

4

74.6

5

BIMP034339

12beta-Hydroxyresibufogenin

400.50

2.6

2

5

83.2

1

BIMP034340

19-Hydroxydesacetylcinobufagin

416.50

1.5

3

6

103.43

2

BIMP034341

Desacetylcinobufotalin

416.50

1.5

3

6

103.43

1

BIMP034342

6-Methyl-1,2,3,4-tetrahydronaphthalene

146.23

3.7

0

BIMP034343

(2Z,6Z)-Farnesyl acetate

264.40

5.3

0

2

26.3

9

BIMP034344

Racemosin

288.29

2.8

0

5

57.9

2

BIMP034345

(2Z,6E)-Farnesyl acetate

264.40

5.3

0

2

26.3

9

BIMP034346

(2E,6Z)-farnesol acetate

264.40

5.3

0

2

26.3

9

BIMP034347

Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, ((1R,7aS)-hexahydro-1H-pyrrolizin-1-yl)methyl ester, (2R,3S)-

285.38

1.4

2

5

70

6

BIMP034348

Coromandaline

285.38

1.4

2

5

70

6

BIMP034349

Actaeaepoxide-3-o-beta-D-xylopyranoside

676.80

2.2

5

11

167.67

5

BIMP034350

Jujubogenin

472.70

6.3

2

4

58.92

1