Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP014276	Dendocarbin G	264.32	2.6	1	4	63.6	0
BIMP014277	propan-2-yl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate	266.29	2.6	1	5	64.99	6
BIMP014278	Neosakuranetin	286.28	3.1	3	5	86.99	4
BIMP014279	2-(4-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one	292.30	3.6	0	4	52.58	2
BIMP014280	Purpuritenin A	292.30	4.4	0	3	39.44	4
BIMP014281	2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]acetaldehyde	294.40	2.1	1	2	36.1	2
BIMP014282	4,4'-Dihydroxy-2',6'-dimethoxychalcone	300.30	2.9	2	5	75.99	5
BIMP014283	[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate	312.27	-0.6	5	8	136.68	4
BIMP014284	Methyl pimarate	316.50	5.9	0	2	26.3	3
BIMP014285	methyl (1R,11S,12S,17S)-12-ethyl-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate	324.40	3.1	1	4	41.57	3
BIMP014286	3,3',5'-Trihydroxy-4-methoxy-5-prenylbibenzyl	328.40	5	3	4	69.92	6
BIMP014287	(3R)-3-hydroxy-12-[(2S,5S)-5-[(1S)-1-hydroxyethyl]pyrrolidin-2-yl]dodecanoic acid	329.50	0.9	4	5	89.79	13
BIMP014288	[(2R,4aR,8R,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2Z)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalen-2-yl] acetate	330.50	6.2	0	2	26.3	5
BIMP014289	Propanoic acid, 2-[bis(2,2,2-trifluoroethoxy)phosphinyl]-, methyl ester	332.13	2	0	11	71.64	7
BIMP014290	(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(1R,2S,5R)-5-(3-hydroxyprop-1-en-2-yl)-2-methylcyclohexyl]oxyoxane-3,4,5-triol	332.39	0.1	5	7	119.61	5
BIMP014291	(1R,13S,14E,19S,21S)-14-(2-Hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6,11-tetraen-9-one	334.40	0.4	1	3	43.78	1
BIMP014292	Artabonatine E	337.30	2.5	0	5	57.23	1
BIMP014293	[(2R,3R,6R)-2-methyl-6-(11-oxododecyl)piperidin-3-yl] acetate	339.50	4.7	1	4	55.4	13
BIMP014294	(5S)-5-[(2S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2-methylcyclohex-2-en-1-one	346.37	-1.5	5	8	136.68	5
BIMP014295	methyl (13R,15R,17R,19R)-13-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate	354.40	2.9	1	4	54.7	3
BIMP014296	(2S,3R,4S,5S,6R)-2-[(1S,2S,5R)-5-[(2S)-1,2-dihydroxypropan-2-yl]-2-hydroxy-2-methylcyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol	366.40	-2.4	7	9	160.07	5
BIMP014297	[(1S,4S,5S,9S,10R,13R,14S)-5-hydroperoxy-14-hydroxy-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate	366.50	3.3	2	5	75.99	4
BIMP014298	4-[(1S,4S,6R)-2,2,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]butan-2-one	374.50	0.8	4	7	116.45	6
BIMP014299	Chilenine	383.40	1.7	1	7	94.53	2
BIMP014300	GlochidionionosideC	386.40	-1.2	5	8	136.68	6

BIMP014276

Dendocarbin G

264.32

2.6

1

4

63.6

0

BIMP014277

propan-2-yl (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

266.29

2.6

1

5

64.99

6

BIMP014278

Neosakuranetin

286.28

3.1

3

5

86.99

4

BIMP014279

2-(4-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one

292.30

3.6

0

4

52.58

2

BIMP014280

Purpuritenin A

292.30

4.4

0

3

39.44

4

BIMP014281

2-[(2R,3E,12bS)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]acetaldehyde

294.40

2.1

1

2

36.1

2

BIMP014282

4,4'-Dihydroxy-2',6'-dimethoxychalcone

300.30

2.9

2

5

75.99

5

BIMP014283

[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

312.27

-0.6

5

8

136.68

4

BIMP014284

Methyl pimarate

316.50

5.9

0

2

26.3

3

BIMP014285

methyl (1R,11S,12S,17S)-12-ethyl-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate

324.40

3.1

1

4

41.57

3

BIMP014286

3,3',5'-Trihydroxy-4-methoxy-5-prenylbibenzyl

328.40

5

3

4

69.92

6

BIMP014287

(3R)-3-hydroxy-12-[(2S,5S)-5-[(1S)-1-hydroxyethyl]pyrrolidin-2-yl]dodecanoic acid

329.50

0.9

4

5

89.79

13

BIMP014288

[(2R,4aR,8R,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2Z)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalen-2-yl] acetate

330.50

6.2

0

2

26.3

5

BIMP014289

Propanoic acid, 2-[bis(2,2,2-trifluoroethoxy)phosphinyl]-, methyl ester

332.13

2

0

11

71.64

7

BIMP014290

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(1R,2S,5R)-5-(3-hydroxyprop-1-en-2-yl)-2-methylcyclohexyl]oxyoxane-3,4,5-triol

332.39

0.1

5

7

119.61

5

BIMP014291

(1R,13S,14E,19S,21S)-14-(2-Hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6,11-tetraen-9-one

334.40

0.4

1

3

43.78

1

BIMP014292

Artabonatine E

337.30

2.5

0

5

57.23

1

BIMP014293

[(2R,3R,6R)-2-methyl-6-(11-oxododecyl)piperidin-3-yl] acetate

339.50

4.7

1

4

55.4

13

BIMP014294

(5S)-5-[(2S)-2-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2-methylcyclohex-2-en-1-one

346.37

-1.5

5

8

136.68

5

BIMP014295

methyl (13R,15R,17R,19R)-13-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate

354.40

2.9

1

4

54.7

3

BIMP014296

(2S,3R,4S,5S,6R)-2-[(1S,2S,5R)-5-[(2S)-1,2-dihydroxypropan-2-yl]-2-hydroxy-2-methylcyclohexyl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

366.40

-2.4

7

9

160.07

5

BIMP014297

[(1S,4S,5S,9S,10R,13R,14S)-5-hydroperoxy-14-hydroxy-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate

366.50

3.3

2

5

75.99

4

BIMP014298

4-[(1S,4S,6R)-2,2,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]butan-2-one

374.50

0.8

4

7

116.45

6

BIMP014299

Chilenine

383.40

1.7

1

7

94.53

2

BIMP014300

GlochidionionosideC

386.40

-1.2

5

8

136.68

6