Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP012351	4-[(E,3S,5R)-3-hydroxy-5-methoxy-7-phenylhept-6-enyl]phenol	312.40	3.9	2	3	49.69	8
BIMP012352	2,3-Dimethylphenol	122.16	2.6	1	1	20.23	0
BIMP012353	(1R,12R)-16-methoxy-3,9,17-tritritio-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-1-ol	320.31	1.7	1	6	66.38	1
BIMP012354	isocudraniaxanthone A	328.30	4	4	6	111.13	2
BIMP012355	(6S)-6-(I(2)-D-Glucopyranosyloxy)-2,6-dimethyl-1,7-octadien-3-one	330.37	-0.2	4	7	116.45	8
BIMP012356	7-[[(2R,3R)-3-methyl-3-[(4-methylidene-5-oxooxolan-2-yl)methyl]oxiran-2-yl]methoxy]chromen-2-one	342.30	2.8	0	6	78.27	5
BIMP012357	Hamilcone	346.30	3.1	3	7	105.45	6
BIMP012358	[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-methyloxan-3-yl] (2E)-6-hydroxy-2-(hydroxymethyl)-6-methylocta-2,7-dienoate	346.37	-1.1	5	8	136.68	8
BIMP012359	calcaratarin A	348.50	5.2	0	3	35.53	7
BIMP012360	Clauslactone K	356.40	3.6	0	6	74.97	6
BIMP012361	8-methoxy-7-[(E)-3-methyl-4-(4-methyl-5-oxooxolan-2-yl)but-2-enoxy]chromen-2-one	358.40	3.8	0	6	74.97	6
BIMP012362	11,12-Di-O-methylcarnosol	358.50	5	0	4	44.76	3
BIMP012363	Gluconic Acid	196.16	-3.4	6	7	138.45	5
BIMP012364	(7S,8S)-4,7,9,9'-Tetrahydroxy-3,3'-dimethoxy-8-O-4'-neolignan	378.40	1.6	4	7	108.61	10
BIMP012365	(3R)-7-hydroxy-3-[6-hydroxy-2,4-dimethoxy-3-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one	384.40	4.2	2	6	85.22	5
BIMP012366	(+)-Surinamensin	388.50	4.1	1	6	66.38	9
BIMP012367	[(1S,2R,4aS,5S,8aS)-1-[2-(furan-3-yl)ethyl]-1-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-2-yl] acetate	392.50	2.4	2	6	96.97	6
BIMP012368	Oleoside 11-methyl ester	404.40	-2	5	11	172.21	7
BIMP012369	(2,4-dihydroxy-6-methoxyphenyl)-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenylcyclohex-3-en-1-yl]methanone	406.50	6.1	2	4	66.76	7
BIMP012370	Ecliptalbine	409.60	6.1	2	3	53.35	2
BIMP012371	butyl (3R)-5-phenyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoate	412.50	1.4	4	8	125.68	12
BIMP012372	Feigrisolide D	414.50	3.4	2	7	102.29	4
BIMP012373	(1R,4R,5R,8R,10S,13R,14R,17R,18R,19S)-10-hydroxy-4,5,9,9,13-pentamethyl-20-oxahexacyclo[17.2.2.01,18.04,17.05,14.08,13]tricosan-21-one	414.60	6.7	1	3	46.53	0
BIMP012374	7-[(E)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methylpent-2-enyl]-9-methylpurin-9-ium-6-amine	422.60	6.4	1	3	60.61	5
BIMP012375	[(3R)-2,2-dimethyl-5,10-dioxo-3,4-dihydrobenzo[g]chromen-3-yl] (E)-5-[(2R,3R)-2,3-dimethyloxiran-2-yl]-2-methylpent-2-enoate	424.50	4	0	6	82.2	6

BIMP012351

4-[(E,3S,5R)-3-hydroxy-5-methoxy-7-phenylhept-6-enyl]phenol

312.40

3.9

2

3

49.69

8

BIMP012352

2,3-Dimethylphenol

122.16

2.6

1

20.23

0

BIMP012353

(1R,12R)-16-methoxy-3,9,17-tritritio-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-1-ol

320.31

1.7

1

6

66.38

1

BIMP012354

isocudraniaxanthone A

328.30

4

6

111.13

2

BIMP012355

(6S)-6-(I(2)-D-Glucopyranosyloxy)-2,6-dimethyl-1,7-octadien-3-one

330.37

-0.2

4

7

116.45

8

BIMP012356

7-[[(2R,3R)-3-methyl-3-[(4-methylidene-5-oxooxolan-2-yl)methyl]oxiran-2-yl]methoxy]chromen-2-one

342.30

2.8

0

6

78.27

5

BIMP012357

Hamilcone

346.30

3.1

3

7

105.45

6

BIMP012358

[(2R,3S,4R,5R)-4,5,6-trihydroxy-2-methyloxan-3-yl] (2E)-6-hydroxy-2-(hydroxymethyl)-6-methylocta-2,7-dienoate

346.37

-1.1

5

8

136.68

8

BIMP012359

calcaratarin A

348.50

5.2

0

3

35.53

7

BIMP012360

Clauslactone K

356.40

3.6

0

6

74.97

6

BIMP012361

8-methoxy-7-[(E)-3-methyl-4-(4-methyl-5-oxooxolan-2-yl)but-2-enoxy]chromen-2-one

358.40

3.8

0

6

74.97

6

BIMP012362

11,12-Di-O-methylcarnosol

358.50

5

0

4

44.76

3

BIMP012363

Gluconic Acid

196.16

-3.4

6

7

138.45

5

BIMP012364

(7S,8S)-4,7,9,9'-Tetrahydroxy-3,3'-dimethoxy-8-O-4'-neolignan

378.40

1.6

4

7

108.61

10

BIMP012365

(3R)-7-hydroxy-3-[6-hydroxy-2,4-dimethoxy-3-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one

384.40

4.2

2

6

85.22

5

BIMP012366

(+)-Surinamensin

388.50

4.1

1

6

66.38

9

BIMP012367

[(1S,2R,4aS,5S,8aS)-1-[2-(furan-3-yl)ethyl]-1-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-3-oxo-4a,6,7,8-tetrahydro-4H-naphthalen-2-yl] acetate

392.50

2.4

2

6

96.97

6

BIMP012368

Oleoside 11-methyl ester

404.40

-2

5

11

172.21

7

BIMP012369

(2,4-dihydroxy-6-methoxyphenyl)-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenylcyclohex-3-en-1-yl]methanone

406.50

6.1

2

4

66.76

7

BIMP012370

Ecliptalbine

409.60

6.1

2

3

53.35

2

BIMP012371

butyl (3R)-5-phenyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoate

412.50

1.4

4

8

125.68

12

BIMP012372

Feigrisolide D

414.50

3.4

2

7

102.29

4

BIMP012373

(1R,4R,5R,8R,10S,13R,14R,17R,18R,19S)-10-hydroxy-4,5,9,9,13-pentamethyl-20-oxahexacyclo[17.2.2.01,18.04,17.05,14.08,13]tricosan-21-one

414.60

6.7

1

3

46.53

0

BIMP012374

7-[(E)-5-[(1R,2S,4aS)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]-3-methylpent-2-enyl]-9-methylpurin-9-ium-6-amine

422.60

6.4

1

3

60.61

5

BIMP012375

[(3R)-2,2-dimethyl-5,10-dioxo-3,4-dihydrobenzo[g]chromen-3-yl] (E)-5-[(2R,3R)-2,3-dimethyloxiran-2-yl]-2-methylpent-2-enoate

424.50

4

0

6

82.2

6