Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP015276	Rutalexin	232.26	2.2	1	3	83.1	0
BIMP015277	(3S,3aR,6S,6aR,10aR)-3,6,9-trimethyl-3,3a,4,5,6,6a,7,8-octahydrobenzo[h][1]benzofuran-2-one	234.33	3.2	0	2	26.3	0
BIMP015278	2,6-Nonadienal	138.21	2.2	0	1	17.07	5
BIMP015279	4,6-Dimethoxyspiro[1,2-dihydroindene-3,4'-cyclohexane]-1'-one	260.33	2.7	0	3	35.53	2
BIMP015280	3-(3,4,5-Trimethoxyphenyl)propyl acetate	268.30	2	0	5	53.99	8
BIMP015281	(E,4R,5R)-4,5-dihydroxy-1-piperidin-1-yldec-2-en-1-one	269.38	1.9	2	3	60.77	7
BIMP015282	(2E)-N-[(2R)-2-Hydroxy-2-(4-hydroxyphenyl)ethyl]-3-phenyl-2-propenamide	283.32	2.1	3	3	69.56	5
BIMP015283	Latifine	285.34	2.5	2	4	52.93	2
BIMP015284	Tetracosanoic acid	368.60	10.7	1	2	37.3	22
BIMP015285	(E)-1,4-bis(4-hydroxyphenyl)-2,3-dimethylbut-2-ene-1,4-dione	296.30	3.2	2	4	74.6	4
BIMP015286	(2Z)-3,7-dimethylocta-2,6-dienal;(2E)-3,7-dimethylocta-2,6-dienal	304.50		0	2	34.14	8
BIMP015287	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (Z)-3-phenylprop-2-enoate	310.30	0.1	4	7	116.45	5
BIMP015288	(3S,3aR,4S,6aR,8S,9S,9aR,9bR)-3-(chloromethyl)-3,4,8-trihydroxy-9-methyl-6-methylidene-4,5,6a,7,8,9,9a,9b-octahydro-3aH-azuleno[4,5-b]furan-2-one	316.77	0.5	3	5	86.99	1
BIMP015289	(2R)-2,3-Dihydroxypropyl 5-deoxy-5-(dimethylarsinyl)-I(2)-D-ribofuranoside	328.19		4	7	116.45	6
BIMP015290	methyl (2S,3S)-2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxylate	332.30	1.7	3	7	105.45	4
BIMP015291	(1R,2R,4S,5R,9S,10S,13R,14S,16R)-2-hydroxy-5,9,14-trimethyl-15-oxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecane-5-carboxylic acid	334.40	3.1	2	4	70.06	1
BIMP015292	Macamide 1	345.60	8.4	1	1	29.1	16
BIMP015293	3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-6-(3-hydroxy-3-methylbutyl)chromen-4-one	372.40	2.9	5	7	131.36	4
BIMP015294	Tricetinidin	287.24		5	5	112.45	1
BIMP015295	(1R,2R,4S,6S,9S,10S,11S,13S,14S)-2,6,11-trihydroxy-14-(methoxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione	380.50	0.5	3	6	104.06	2
BIMP015296	8'-epi-cleomiscosin A	386.40	2.1	2	8	107.59	4
BIMP015297	(2E)-5-hydroxy-2-(5-hydroxy-4-methoxy-7-methyl-1-oxonaphthalen-2-ylidene)-4-methoxy-7-methylnaphthalen-1-one	404.40	3.8	2	6	93.06	2
BIMP015298	Sacidumlignan D	404.50	3.6	2	7	86.61	6
BIMP015299	(2S,3R,10S)-5-hydroxy-2,3-dimethyl-6-(3-methylbut-2-enyl)-10-phenyl-2,3,9,10-tetrahydropyrano[2,3-h]chromene-4,8-dione	406.50	5.7	1	5	72.83	3
BIMP015300	Flabellinone	410.60	5.9	1	3	54.37	0

BIMP015276

Rutalexin

232.26

2.2

1

3

83.1

0

BIMP015277

(3S,3aR,6S,6aR,10aR)-3,6,9-trimethyl-3,3a,4,5,6,6a,7,8-octahydrobenzo[h][1]benzofuran-2-one

234.33

3.2

0

2

26.3

0

BIMP015278

2,6-Nonadienal

138.21

2.2

0

1

17.07

5

BIMP015279

4,6-Dimethoxyspiro[1,2-dihydroindene-3,4'-cyclohexane]-1'-one

260.33

2.7

0

3

35.53

2

BIMP015280

3-(3,4,5-Trimethoxyphenyl)propyl acetate

268.30

2

0

5

53.99

8

BIMP015281

(E,4R,5R)-4,5-dihydroxy-1-piperidin-1-yldec-2-en-1-one

269.38

1.9

2

3

60.77

7

BIMP015282

(2E)-N-[(2R)-2-Hydroxy-2-(4-hydroxyphenyl)ethyl]-3-phenyl-2-propenamide

283.32

2.1

3

69.56

5

BIMP015283

Latifine

285.34

2.5

2

4

52.93

2

BIMP015284

Tetracosanoic acid

368.60

10.7

1

2

37.3

22

BIMP015285

(E)-1,4-bis(4-hydroxyphenyl)-2,3-dimethylbut-2-ene-1,4-dione

296.30

3.2

2

4

74.6

4

BIMP015286

(2Z)-3,7-dimethylocta-2,6-dienal;(2E)-3,7-dimethylocta-2,6-dienal

304.50

0

2

34.14

8

BIMP015287

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (Z)-3-phenylprop-2-enoate

310.30

0.1

4

7

116.45

5

BIMP015288

(3S,3aR,4S,6aR,8S,9S,9aR,9bR)-3-(chloromethyl)-3,4,8-trihydroxy-9-methyl-6-methylidene-4,5,6a,7,8,9,9a,9b-octahydro-3aH-azuleno[4,5-b]furan-2-one

316.77

0.5

3

5

86.99

1

BIMP015289

(2R)-2,3-Dihydroxypropyl 5-deoxy-5-(dimethylarsinyl)-I(2)-D-ribofuranoside

328.19

4

7

116.45

6

BIMP015290

methyl (2S,3S)-2-(3,4-dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxylate

332.30

1.7

3

7

105.45

4

BIMP015291

(1R,2R,4S,5R,9S,10S,13R,14S,16R)-2-hydroxy-5,9,14-trimethyl-15-oxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecane-5-carboxylic acid

334.40

3.1

2

4

70.06

1

BIMP015292

Macamide 1

345.60

8.4

1

29.1

16

BIMP015293

3-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-6-(3-hydroxy-3-methylbutyl)chromen-4-one

372.40

2.9

5

7

131.36

4

BIMP015294

Tricetinidin

287.24

5

112.45

1

BIMP015295

(1R,2R,4S,6S,9S,10S,11S,13S,14S)-2,6,11-trihydroxy-14-(methoxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,15-dione

380.50

0.5

3

6

104.06

2

BIMP015296

8'-epi-cleomiscosin A

386.40

2.1

2

8

107.59

4

BIMP015297

(2E)-5-hydroxy-2-(5-hydroxy-4-methoxy-7-methyl-1-oxonaphthalen-2-ylidene)-4-methoxy-7-methylnaphthalen-1-one

404.40

3.8

2

6

93.06

2

BIMP015298

Sacidumlignan D

404.50

3.6

2

7

86.61

6

BIMP015299

(2S,3R,10S)-5-hydroxy-2,3-dimethyl-6-(3-methylbut-2-enyl)-10-phenyl-2,3,9,10-tetrahydropyrano[2,3-h]chromene-4,8-dione

406.50

5.7

1

5

72.83

3

BIMP015300

Flabellinone

410.60

5.9

1

3

54.37

0