Chemical Library : Dataset Browser

BIMP_ID	Name	Mol Weight	LogP	HBD	HBA	TPSA	Rotatable Bonds
BIMP023901	(2Z,4E,6Z,8E,10E,12Z)-tetradeca-2,4,6,8,10,12-hexaenedioic acid	246.26	2.8	2	4	74.6	7
BIMP023902	Vinaginsenoside R16	917.10	2.5	11	17	277.91	12
BIMP023903	Vinaginsenoside R17	917.10	2.5	11	17	277.91	12
BIMP023904	Withaperuvin F	502.60	0.1	4	8	133.52	2
BIMP023905	Physalin I	558.60	-0.3	2	11	154.89	1
BIMP023906	2'-Methoxyphaseollinisoflavan (incorr.)	338.40	3.9	1	4	47.92	2
BIMP023907	DELTA3,5-Deoxyneotigogenin	396.60	6.9	0	2	18.46	0
BIMP023908	[(2Z,4S,8R,9R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl] (Z)-2-methylbut-2-enoate	378.40	1.1	2	7	102.29	3
BIMP023909	[(10Z)-7,9-dihydroxy-10-methyl-3,6-dimethylidene-2-oxo-4,5,7,8,9,11a-hexahydro-3aH-cyclodeca[b]furan-4-yl] (Z)-2-methylbut-2-enoate	362.40	1.5	2	6	93.06	3
BIMP023910	(23R)-Acetoxytomatine	1092.20	-1.1	13	24	364.16	13
BIMP023911	Valepotriatum	212.20	-2.5	3	5	82.45	1
BIMP023912	(3beta,11alpha,13beta)-3,11,13-Oleananetriol	460.70	7.3	3	3	60.69	0
BIMP023913	Lucyoside M	837.00	2.7	7	15	238.97	10
BIMP023914	Avenacin A1	1094.20	0.6	12	22	345.84	14
BIMP023915	Secaloside A	1001.90	-3.3	12	24	385.91	13
BIMP023916	8-O-Methyloblongine	328.40	3.4	1	3	38.69	4
BIMP023917	(1S,3S,4S,5R,6x,8x)-1,5-Diacetoxy-8-angeloyloxy-3,4-epoxy-7(14),10-bisaboladien-2-one	448.50	3.7	0	8	108.5	11
BIMP023918	Zucchini factor B	663.90	10.8	1	5	78.62	7
BIMP023919	Vinaginsenoside R24	963.20	1.2	13	19	318.37	14
BIMP023920	(4Z,9a)-9-(3-Methyl-2-butenoyloxy)-4,10(14)-oplopadien-3-one	316.40	4	0	3	43.37	4
BIMP023921	(4Z,9a)-9-Angeloyloxy-4,10(14)-oplopadien-3-one	316.40	3.8	0	3	43.37	4
BIMP023922	(4E,9a)-9-(3-Methyl-2E-pentenoyloxy)-4,10(14)-oplopadien-3-one	330.50	4.5	0	3	43.37	5
BIMP023923	Phytolaccoside A	648.80	3.4	5	10	162.98	6
BIMP023924	(3b,6a,12b,20S,23E)-Dammar-23-ene-3,6,12,20,25-pentol 6,20-diglucoside	817.00	1	11	15	259.45	10
BIMP023925	Cinncassiol D1 glucoside	514.60	-0.6	7	10	169.3	5

BIMP023901

(2Z,4E,6Z,8E,10E,12Z)-tetradeca-2,4,6,8,10,12-hexaenedioic acid

246.26

2.8

2

4

74.6

7

BIMP023902

Vinaginsenoside R16

917.10

2.5

11

17

277.91

12

BIMP023903

Vinaginsenoside R17

917.10

2.5

11

17

277.91

12

BIMP023904

Withaperuvin F

502.60

0.1

4

8

133.52

2

BIMP023905

Physalin I

558.60

-0.3

2

11

154.89

1

BIMP023906

2'-Methoxyphaseollinisoflavan (incorr.)

338.40

3.9

1

4

47.92

2

BIMP023907

DELTA3,5-Deoxyneotigogenin

396.60

6.9

0

2

18.46

0

BIMP023908

[(2Z,4S,8R,9R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl] (Z)-2-methylbut-2-enoate

378.40

1.1

2

7

102.29

3

BIMP023909

[(10Z)-7,9-dihydroxy-10-methyl-3,6-dimethylidene-2-oxo-4,5,7,8,9,11a-hexahydro-3aH-cyclodeca[b]furan-4-yl] (Z)-2-methylbut-2-enoate

362.40

1.5

2

6

93.06

3

BIMP023910

(23R)-Acetoxytomatine

1092.20

-1.1

13

24

364.16

13

BIMP023911

Valepotriatum

212.20

-2.5

3

5

82.45

1

BIMP023912

(3beta,11alpha,13beta)-3,11,13-Oleananetriol

460.70

7.3

3

60.69

0

BIMP023913

Lucyoside M

837.00

2.7

7

15

238.97

10

BIMP023914

Avenacin A1

1094.20

0.6

12

22

345.84

14

BIMP023915

Secaloside A

1001.90

-3.3

12

24

385.91

13

BIMP023916

8-O-Methyloblongine

328.40

3.4

1

3

38.69

4

BIMP023917

(1S,3S,4S,5R,6x,8x)-1,5-Diacetoxy-8-angeloyloxy-3,4-epoxy-7(14),10-bisaboladien-2-one

448.50

3.7

0

8

108.5

11

BIMP023918

Zucchini factor B

663.90

10.8

1

5

78.62

7

BIMP023919

Vinaginsenoside R24

963.20

1.2

13

19

318.37

14

BIMP023920

(4Z,9a)-9-(3-Methyl-2-butenoyloxy)-4,10(14)-oplopadien-3-one

316.40

4

0

3

43.37

4

BIMP023921

(4Z,9a)-9-Angeloyloxy-4,10(14)-oplopadien-3-one

316.40

3.8

0

3

43.37

4

BIMP023922

(4E,9a)-9-(3-Methyl-2E-pentenoyloxy)-4,10(14)-oplopadien-3-one

330.50

4.5

0

3

43.37

5

BIMP023923

Phytolaccoside A

648.80

3.4

5

10

162.98

6

BIMP023924

(3b,6a,12b,20S,23E)-Dammar-23-ene-3,6,12,20,25-pentol 6,20-diglucoside

817.00

1

11

15

259.45

10

BIMP023925

Cinncassiol D1 glucoside

514.60

-0.6

7

10

169.3

5