Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP028776	2,7-Dimethyloctane	142.28	5.1	0	0	0	5
BIMP028777	Paniculidine B	233.31	3.1	1	2	34.39	5
BIMP028778	Tridecyl acetate	242.40	6.1	0	2	26.3	13
BIMP028779	Propylene sulfide	74.15	1.1	0	1	25.3	0
BIMP028780	Triacontan-2-OL	438.80	14.8	1	1	20.23	27
BIMP028781	2-Octyn-1-ol	126.20	2.2	1	1	20.23	3
BIMP028782	4-Methyloctan-3-one	142.24	2.9	0	1	17.07	5
BIMP028783	2(3H)-Furanone	84.07	0.2	0	2	26.3	0
BIMP028784	Cyperol	220.35	3.4	1	1	20.23	1
BIMP028785	Isocyperol	220.35	4	1	1	20.23	1
BIMP028786	(2R,4aS,7R,8aR)-4a-Methyl-1-methylidene-7-(prop-1-en-2-yl)decahydronaphthalen-2-ol	220.35	4	1	1	20.23	1
BIMP028787	3-Hydroxy-4,9-dimethoxypterocarpan	300.30	2.6	1	5	57.15	2
BIMP028788	1,3-Dihydroxy-5,6-dimethoxyxanthen-9-one	288.25	2.7	2	6	89.13	2
BIMP028789	[(2R,3S,4S,5R,6S)-6-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate	558.50	1.6	9	13	226.83	8
BIMP028790	8-Hydroxy-2-(8-hydroxy-4-methoxy-6-methyl-1-oxonaphthalen-2-ylidene)-4-methoxy-6-methylnaphthalen-1-one	404.40	4.9	2	6	93.06	2
BIMP028791	Dihydrosuberenol	262.30	2.4	1	4	59.67	4
BIMP028792	Citrubuntin	242.27	3.9	0	3	39.44	3
BIMP028793	Teralin	284.26	2.4	2	5	79.9	2
BIMP028794	Haginin B	270.28	2.7	2	4	58.92	2
BIMP028795	Haginin D	256.25	2.4	3	4	69.92	1
BIMP028796	methyl schisantherin F	500.60	5.1	1	8	92.68	8
BIMP028797	Kaempferol 3-O-alpha-L-rhamnofuranoside	432.40	1.8	6	10	170.05	4
BIMP028798	Eriodictyol 7,3',4'-trimethyl ether	330.30	3	1	6	74.22	4
BIMP028799	2-Acetylpyrrole	109.13	0.9	1	1	32.86	1
BIMP028800	Icariside F2	402.40	-2.3	6	10	158.3	7

BIMP028776

2,7-Dimethyloctane

142.28

5.1

0

5

BIMP028777

Paniculidine B

233.31

3.1

1

2

34.39

5

BIMP028778

Tridecyl acetate

242.40

6.1

0

2

26.3

13

BIMP028779

Propylene sulfide

74.15

1.1

0

1

25.3

0

BIMP028780

Triacontan-2-OL

438.80

14.8

1

20.23

27

BIMP028781

2-Octyn-1-ol

126.20

2.2

1

20.23

3

BIMP028782

4-Methyloctan-3-one

142.24

2.9

0

1

17.07

5

BIMP028783

2(3H)-Furanone

84.07

0.2

0

2

26.3

0

BIMP028784

Cyperol

220.35

3.4

1

20.23

1

BIMP028785

Isocyperol

220.35

4

1

20.23

1

BIMP028786

(2R,4aS,7R,8aR)-4a-Methyl-1-methylidene-7-(prop-1-en-2-yl)decahydronaphthalen-2-ol

220.35

4

1

20.23

1

BIMP028787

3-Hydroxy-4,9-dimethoxypterocarpan

300.30

2.6

1

5

57.15

2

BIMP028788

1,3-Dihydroxy-5,6-dimethoxyxanthen-9-one

288.25

2.7

2

6

89.13

2

BIMP028789

[(2R,3S,4S,5R,6S)-6-[4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-hydroxyphenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

558.50

1.6

9

13

226.83

8

BIMP028790

8-Hydroxy-2-(8-hydroxy-4-methoxy-6-methyl-1-oxonaphthalen-2-ylidene)-4-methoxy-6-methylnaphthalen-1-one

404.40

4.9

2

6

93.06

2

BIMP028791

Dihydrosuberenol

262.30

2.4

1

4

59.67

4

BIMP028792

Citrubuntin

242.27

3.9

0

3

39.44

3

BIMP028793

Teralin

284.26

2.4

2

5

79.9

2

BIMP028794

Haginin B

270.28

2.7

2

4

58.92

2

BIMP028795

Haginin D

256.25

2.4

3

4

69.92

1

BIMP028796

methyl schisantherin F

500.60

5.1

1

8

92.68

8

BIMP028797

Kaempferol 3-O-alpha-L-rhamnofuranoside

432.40

1.8

6

10

170.05

4

BIMP028798

Eriodictyol 7,3',4'-trimethyl ether

330.30

3

1

6

74.22

4

BIMP028799

2-Acetylpyrrole

109.13

0.9

1

32.86

1

BIMP028800

Icariside F2

402.40

-2.3

6

10

158.3

7