Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP016451	(5r,6s)-5-Ethenyl-4a-hydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[5,4-c]pyran-1-one	374.34	-2	5	10	155.14	4
BIMP016452	(1S,4R)-3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-ol	218.33	3.9	1	1	20.23	1
BIMP016453	2-methyl-4-[(1R)-1,2,2-trimethylcyclopentyl]phenol	218.33	5.1	1	1	20.23	1
BIMP016454	Encecalin	232.27	2.5	0	3	35.53	2
BIMP016455	4(15)-Eudesmene-1beta,7alpha-diol	238.37	2.5	2	2	40.46	1
BIMP016456	7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-6-one, dodecahydro-, [7R-(7alpha,7abeta,14alpha,14aalpha)]-	248.36	1.7	0	2	23.55	0
BIMP016457	(3E,4S)-3-decylidene-4-hydroxy-5-methylideneoxolan-2-one	252.35	4.6	1	3	46.53	8
BIMP016458	Isophorbol	364.40	-0.8	5	6	118.22	1
BIMP016459	(2S,4R,5S)-4-hydroxy-5-methoxy-2-[(1R)-1-phenylprop-2-enyl]cyclohexan-1-one	260.33	1.9	1	3	46.53	4
BIMP016460	(2Z,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylpenta-2,4-dien-1-one	271.31	3.1	0	3	38.77	3
BIMP016461	(1S,18R)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraen-18-ol	271.31	1.1	1	4	41.93	0
BIMP016462	Ent-cassa-12,15-diene	272.50	6.9	0	0	0	1
BIMP016463	(1R,4S,5S,6S,8S,9R)-5,8-dihydroxy-6-methyl-13-azatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one	279.37	0.7	2	4	60.77	0
BIMP016464	5-Deoxycajanin	284.26	2.4	2	5	79.9	2
BIMP016465	2-(4-Hydroxy-2,5-dimethoxyphenyl)-1-benzofuran-6-ol	286.28	3.2	2	5	72.06	3
BIMP016466	Hydroxyanigorufone	288.30	4.3	2	3	57.53	1
BIMP016467	Laurinterol	295.21	5.3	1	1	20.23	1
BIMP016468	Aurentiacin	298.30	4.2	1	4	55.76	5
BIMP016469	[8-(4-Hydroxy-3-methoxyphenyl)-6-oxooctan-4-yl] acetate	308.40	2.6	1	5	72.83	10
BIMP016470	[7]-Gingerol	308.40	3.6	2	4	66.76	11
BIMP016471	Pulchelstyrene C	316.30	3.7	2	5	68.15	6
BIMP016472	3-epi-Padmatin	318.28	1.8	4	7	116.45	2
BIMP016473	Neosalvianen	319.40	5.5	0	3	39.17	0
BIMP016474	Bis(2-methylpropanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene	320.40	3.3	0	5	65.13	8
BIMP016475	Austroinulin	322.50	4.5	3	3	60.69	3

BIMP016451

(5r,6s)-5-Ethenyl-4a-hydroxy-6-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[5,4-c]pyran-1-one

374.34

-2

5

10

155.14

4

BIMP016452

(1S,4R)-3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-ol

218.33

3.9

1

20.23

1

BIMP016453

2-methyl-4-[(1R)-1,2,2-trimethylcyclopentyl]phenol

218.33

5.1

1

20.23

1

BIMP016454

Encecalin

232.27

2.5

0

3

35.53

2

BIMP016455

4(15)-Eudesmene-1beta,7alpha-diol

238.37

2.5

2

40.46

1

BIMP016456

7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-6-one, dodecahydro-, [7R-(7alpha,7abeta,14alpha,14aalpha)]-

248.36

1.7

0

2

23.55

0

BIMP016457

(3E,4S)-3-decylidene-4-hydroxy-5-methylideneoxolan-2-one

252.35

4.6

1

3

46.53

8

BIMP016458

Isophorbol

364.40

-0.8

5

6

118.22

1

BIMP016459

(2S,4R,5S)-4-hydroxy-5-methoxy-2-[(1R)-1-phenylprop-2-enyl]cyclohexan-1-one

260.33

1.9

1

3

46.53

4

BIMP016460

(2Z,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylpenta-2,4-dien-1-one

271.31

3.1

0

3

38.77

3

BIMP016461

(1S,18R)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraen-18-ol

271.31

1.1

1

4

41.93

0

BIMP016462

Ent-cassa-12,15-diene

272.50

6.9

0

1

BIMP016463

(1R,4S,5S,6S,8S,9R)-5,8-dihydroxy-6-methyl-13-azatetracyclo[7.7.0.01,13.04,9]hexadecan-2-one

279.37

0.7

2

4

60.77

0

BIMP016464

5-Deoxycajanin

284.26

2.4

2

5

79.9

2

BIMP016465

2-(4-Hydroxy-2,5-dimethoxyphenyl)-1-benzofuran-6-ol

286.28

3.2

2

5

72.06

3

BIMP016466

Hydroxyanigorufone

288.30

4.3

2

3

57.53

1

BIMP016467

Laurinterol

295.21

5.3

1

20.23

1

BIMP016468

Aurentiacin

298.30

4.2

1

4

55.76

5

BIMP016469

[8-(4-Hydroxy-3-methoxyphenyl)-6-oxooctan-4-yl] acetate

308.40

2.6

1

5

72.83

10

BIMP016470

[7]-Gingerol

308.40

3.6

2

4

66.76

11

BIMP016471

Pulchelstyrene C

316.30

3.7

2

5

68.15

6

BIMP016472

3-epi-Padmatin

318.28

1.8

4

7

116.45

2

BIMP016473

Neosalvianen

319.40

5.5

0

3

39.17

0

BIMP016474

Bis(2-methylpropanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene

320.40

3.3

0

5

65.13

8

BIMP016475

Austroinulin

322.50

4.5

3

60.69

3