Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP029451	Aloeresin D	556.60	1.7	5	11	176.12	9
BIMP029452	Aloenin-2'-p-coumaroyl ester	556.50	2.3	5	12	185.35	9
BIMP029453	1,8-dihydroxy-3-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]anthracene-9,10-dione	416.40	0.7	5	9	153.75	3
BIMP029454	(9R,10R)-9,10-dihydroxyhexadecanoic acid	288.42	4.1	3	4	77.76	14
BIMP029455	2,3-di-O-methyl-alpha-D-glucopyranose	208.21	-1.5	3	6	88.38	3
BIMP029456	15,16-Epoxy-9,12-octadecadienoic acid	294.40	5.1	1	3	49.83	13
BIMP029457	[(2S,3R,4S,5R,6R)-3-hexanoyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate	376.40	2.4	3	8	122.52	13
BIMP029458	[(2R,3R,4S,5R,6R)-2,3-di(hexanoyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate	474.60	4.9	2	9	128.59	19
BIMP029459	3,4-Octadiene, 7-methyl-	124.22	2.9	0	0	0	3
BIMP029460	7-Methyl-3-octyne	124.22	3.6	0	0	0	2
BIMP029461	5-(3-Hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran	298.30	3.5	2	4	62.83	5
BIMP029462	2-(2-Hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran	298.30	3.5	2	4	62.83	5
BIMP029463	Rataniaphenol III	280.30	4.6	1	3	42.6	3
BIMP029464	(2S,3S)-2,3-dihydro-3-hydroxymethyl-2-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran	282.30	3.2	2	3	49.69	3
BIMP029465	(+)-Larreatricin	284.30	3.8	2	3	49.69	2
BIMP029466	Meso-3,3'-Didemethoxynectandrin B	284.30	3.8	2	3	49.69	2
BIMP029467	2-methoxy-4-[(2S,3S)-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydrobenzofuran-2-yl]phenol	296.40	4.4	1	3	38.69	3
BIMP029468	[(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl]butyl] acetate	474.50	4.3	0	8	89.52	15
BIMP029469	27-Methyl-1,3-octacosanediol	440.80	12.7	2	2	40.46	26
BIMP029470	(1R,6bR,7R,12bR)-1,4,7,10-tetrahydroxy-1,2,6b,7,8,12b-hexahydroperylene-3,9-dione	352.30	1.5	4	6	115.06	0
BIMP029471	(1R,12aS,12bR)-1,4,9,12a-tetrahydroxy-2,12b-dihydro-1H-perylene-3,10-dione	350.30	1.6	4	6	115.06	0
BIMP029472	Chrysophanol 1-triglucoside	740.70	-2.5	11	19	312.05	9
BIMP029473	Chrysophanol 1-tetraglucoside	902.80	-4.6	14	24	391.2	12
BIMP029474	Triumbelletin	482.40	4.5	2	9	140.32	3
BIMP029475	9-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxyfuro[3,2-g]chromen-7-one	300.30	2.6	1	5	72.81	3

BIMP029451

Aloeresin D

556.60

1.7

5

11

176.12

9

BIMP029452

Aloenin-2'-p-coumaroyl ester

556.50

2.3

5

12

185.35

9

BIMP029453

1,8-dihydroxy-3-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]anthracene-9,10-dione

416.40

0.7

5

9

153.75

3

BIMP029454

(9R,10R)-9,10-dihydroxyhexadecanoic acid

288.42

4.1

3

4

77.76

14

BIMP029455

2,3-di-O-methyl-alpha-D-glucopyranose

208.21

-1.5

3

6

88.38

3

BIMP029456

15,16-Epoxy-9,12-octadecadienoic acid

294.40

5.1

1

3

49.83

13

BIMP029457

[(2S,3R,4S,5R,6R)-3-hexanoyloxy-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate

376.40

2.4

3

8

122.52

13

BIMP029458

[(2R,3R,4S,5R,6R)-2,3-di(hexanoyloxy)-5-hydroxy-6-(hydroxymethyl)oxan-4-yl] hexanoate

474.60

4.9

2

9

128.59

19

BIMP029459

3,4-Octadiene, 7-methyl-

124.22

2.9

0

3

BIMP029460

7-Methyl-3-octyne

124.22

3.6

0

2

BIMP029461

5-(3-Hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran

298.30

3.5

2

4

62.83

5

BIMP029462

2-(2-Hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran

298.30

3.5

2

4

62.83

5

BIMP029463

Rataniaphenol III

280.30

4.6

1

3

42.6

3

BIMP029464

(2S,3S)-2,3-dihydro-3-hydroxymethyl-2-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran

282.30

3.2

2

3

49.69

3

BIMP029465

(+)-Larreatricin

284.30

3.8

2

3

49.69

2

BIMP029466

Meso-3,3'-Didemethoxynectandrin B

284.30

3.8

2

3

49.69

2

BIMP029467

2-methoxy-4-[(2S,3S)-3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydrobenzofuran-2-yl]phenol

296.40

4.4

1

3

38.69

3

BIMP029468

[(2R,3R)-3-(acetyloxymethyl)-4-(3,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)methyl]butyl] acetate

474.50

4.3

0

8

89.52

15

BIMP029469

27-Methyl-1,3-octacosanediol

440.80

12.7

2

40.46

26

BIMP029470

(1R,6bR,7R,12bR)-1,4,7,10-tetrahydroxy-1,2,6b,7,8,12b-hexahydroperylene-3,9-dione

352.30

1.5

4

6

115.06

0

BIMP029471

(1R,12aS,12bR)-1,4,9,12a-tetrahydroxy-2,12b-dihydro-1H-perylene-3,10-dione

350.30

1.6

4

6

115.06

0

BIMP029472

Chrysophanol 1-triglucoside

740.70

-2.5

11

19

312.05

9

BIMP029473

Chrysophanol 1-tetraglucoside

902.80

-4.6

14

24

391.2

12

BIMP029474

Triumbelletin

482.40

4.5

2

9

140.32

3

BIMP029475

9-[(E)-3-hydroxy-3-methylbut-1-enyl]-4-methoxyfuro[3,2-g]chromen-7-one

300.30

2.6

1

5

72.81

3