Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP023451	1-Chloro-8-(3-heptyloxiran-2-yl)octa-4,6-diyne-2,3-diol	312.80	3.6	2	3	52.99	10
BIMP023452	(2S,3R)-2,3-dihydroxy-3-methyl-6-propan-2-ylidenecyclohexan-1-one	184.23	0.8	2	3	57.53	0
BIMP023453	(4S,4aR,6S,7R,7aS)-2,4,7-trimethyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-6-ol	183.29	1.7	1	2	23.47	0
BIMP023454	(E)-8(9)-p-Menthen-1,2-diol	170.25	1.5	2	2	40.46	1
BIMP023455	6-Oxabicyclo[3.1.0]hexane-3-acetaldehyde, 1,2,2-trimethyl-, (1I+/-,3I+/-,5I+/-)-(-)-	168.23	1.2	0	2	29.6	2
BIMP023456	(1R,3S,4S,6R)-3-(hydroxymethyl)-1,3-dimethyl-2-oxabicyclo[2.2.2]octan-6-ol	186.25	0.2	2	3	49.69	1
BIMP023457	4-(2'-Furyl-5'-methyl)-butan-2-one	152.19	1.7	0	2	30.21	4
BIMP023458	(3S)-7,8-dihydroxy-3-methyl-3,4-dihydroisochromen-1-one	194.18	2.1	2	4	66.76	0
BIMP023459	Picrocrocin	330.37	-0.5	4	7	116.45	4
BIMP023460	5'-phosphoribosyl-N-formylglycinamide	314.19	-4.3	6	9	184.46	6
BIMP023461	1,3-Dihydroxy-6-methyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-YL]oxy}anthracene-9,10-dione	432.40	0.9	6	10	173.98	3
BIMP023462	Agrimonolide-6-O-glucopyranoside	476.50	2.2	5	10	155.14	7
BIMP023463	5alpha-Cholestan-3beta-ol, acetate	430.70	9.9	0	2	26.3	7
BIMP023464	6,7-Dimethoxy-3-(6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-benzofuran-1(3H)-one	383.40	2.7	0	7	66.46	3
BIMP023465	(4R,4aS,5R)-4-hydroxy-5-methyl-4a,5,6,7-tetrahydro-4H-naphthalen-1-one	178.23	1.5	1	2	37.3	0
BIMP023466	Squamone	594.90	7.6	2	7	110.13	26
BIMP023467	Tetrahydro-4-hydroxy-6-propylpyran-2-one	158.19	0.9	1	3	46.53	2
BIMP023468	(2R,3S,5S,6S)-3-methoxy-6-methyloxane-2,5-diol	162.18	-0.6	2	4	58.92	1
BIMP023469	(1S,4S,5S)-1-methyl-4-propan-2-ylbicyclo[3.1.0]hexan-2-one	152.23	2	0	1	17.07	1
BIMP023470	(4R,4aS,5R,7S)-4,7-dihydroxy-5-methyl-4a,5,6,7-tetrahydro-4H-naphthalen-1-one	194.23	0.2	2	3	57.53	0
BIMP023471	N-[(3R,4R,5S)-4,5-dimethyl-2-oxooxolan-3-yl]acetamide	171.19	0.5	1	3	55.4	1
BIMP023472	alpha-Bisabolone oxide A	238.37	2.5	1	2	29.46	1
BIMP023473	Bisabolol oxide A	238.37	2.5	1	2	29.46	1
BIMP023474	(4aR,5S,7aS)-7-(hydroxymethyl)-5-methoxy-4,4a,5,7a-tetrahydro-1H-cyclopenta[c]pyran-3-one	198.22	-0.9	1	4	55.76	2
BIMP023475	Glc(b1-6)b-Glc1Me	356.32	-4.2	7	11	178.53	5

BIMP023451

1-Chloro-8-(3-heptyloxiran-2-yl)octa-4,6-diyne-2,3-diol

312.80

3.6

2

3

52.99

10

BIMP023452

(2S,3R)-2,3-dihydroxy-3-methyl-6-propan-2-ylidenecyclohexan-1-one

184.23

0.8

2

3

57.53

0

BIMP023453

(4S,4aR,6S,7R,7aS)-2,4,7-trimethyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-6-ol

183.29

1.7

1

2

23.47

0

BIMP023454

(E)-8(9)-p-Menthen-1,2-diol

170.25

1.5

2

40.46

1

BIMP023455

6-Oxabicyclo[3.1.0]hexane-3-acetaldehyde, 1,2,2-trimethyl-, (1I+/-,3I+/-,5I+/-)-(-)-

168.23

1.2

0

2

29.6

2

BIMP023456

(1R,3S,4S,6R)-3-(hydroxymethyl)-1,3-dimethyl-2-oxabicyclo[2.2.2]octan-6-ol

186.25

0.2

2

3

49.69

1

BIMP023457

4-(2'-Furyl-5'-methyl)-butan-2-one

152.19

1.7

0

2

30.21

4

BIMP023458

(3S)-7,8-dihydroxy-3-methyl-3,4-dihydroisochromen-1-one

194.18

2.1

2

4

66.76

0

BIMP023459

Picrocrocin

330.37

-0.5

4

7

116.45

4

BIMP023460

5'-phosphoribosyl-N-formylglycinamide

314.19

-4.3

6

9

184.46

6

BIMP023461

1,3-Dihydroxy-6-methyl-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-YL]oxy}anthracene-9,10-dione

432.40

0.9

6

10

173.98

3

BIMP023462

Agrimonolide-6-O-glucopyranoside

476.50

2.2

5

10

155.14

7

BIMP023463

5alpha-Cholestan-3beta-ol, acetate

430.70

9.9

0

2

26.3

7

BIMP023464

6,7-Dimethoxy-3-(6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-2-benzofuran-1(3H)-one

383.40

2.7

0

7

66.46

3

BIMP023465

(4R,4aS,5R)-4-hydroxy-5-methyl-4a,5,6,7-tetrahydro-4H-naphthalen-1-one

178.23

1.5

1

2

37.3

0

BIMP023466

Squamone

594.90

7.6

2

7

110.13

26

BIMP023467

Tetrahydro-4-hydroxy-6-propylpyran-2-one

158.19

0.9

1

3

46.53

2

BIMP023468

(2R,3S,5S,6S)-3-methoxy-6-methyloxane-2,5-diol

162.18

-0.6

2

4

58.92

1

BIMP023469

(1S,4S,5S)-1-methyl-4-propan-2-ylbicyclo[3.1.0]hexan-2-one

152.23

2

0

1

17.07

1

BIMP023470

(4R,4aS,5R,7S)-4,7-dihydroxy-5-methyl-4a,5,6,7-tetrahydro-4H-naphthalen-1-one

194.23

0.2

2

3

57.53

0

BIMP023471

N-[(3R,4R,5S)-4,5-dimethyl-2-oxooxolan-3-yl]acetamide

171.19

0.5

1

3

55.4

1

BIMP023472

alpha-Bisabolone oxide A

238.37

2.5

1

2

29.46

1

BIMP023473

Bisabolol oxide A

238.37

2.5

1

2

29.46

1

BIMP023474

(4aR,5S,7aS)-7-(hydroxymethyl)-5-methoxy-4,4a,5,7a-tetrahydro-1H-cyclopenta[c]pyran-3-one

198.22

-0.9

1

4

55.76

2

BIMP023475

Glc(b1-6)b-Glc1Me

356.32

-4.2

7

11

178.53

5