Home
|
Screening data
|
Screen comparisons
|
Search for compounds
|
Structure search
Compound Information
SONAR Target prediction
Name:
3-NOR-3-OXOPANASINSAN-6-OL
Unique Identifier:
SPE00300110
MolClass:
Checkout models in
ver1.5
and
ver1.0
Molecular Formula:
Molecular Weight:
200.149 g/mol
X log p:
-1.167
(online calculus)
Lipinksi Failures
0
TPSA
17.07
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptors Count:
2
Rotatable Bond Count:
0
Canonical Smiles:
CC1(C)CC23C1CCC2(C)C(O)CCC3=O
Class:
sesquiterpene
Source:
derivative Panax ginseng
Reference:
Chem Pharm Bull 35: 1975 (1987)
Found: 205 nonactive as graph:
single
|
with analogs
[1]
<< Back
191
192
193
194
195
196
197
198
199
200
Next >>
[205]
Species:
4932
Condition:
YPT6
Replicates:
2
Raw OD Value:
r
im
0.5627±0.0177484
Normalized OD Score:
sc
h
1.0416±0.0163264
Z-Score:
0.7580±0.270537
p-Value:
0.456698
Z-Factor:
-1.75348
Fitness Defect:
0.7837
Bioactivity Statement:
Nonactive
Experimental Conditions
Library:
SPECMTS3
Plate Number and Position:
9|G7
Drug Concentration:
50.00 nM
OD Absorbance:
600 nm
Robot Temperature:
25.50 Celcius
Date:
2008-06-05 YYYY-MM-DD
Plate CH Control (+):
0.04085±0.00043
Plate DMSO Control (-):
0.53375±0.01083
Plate Z-Factor:
0.9136
png
ps
pdf
DBLink | Rows returned: 130
[1]
<< Back
1
2
3
4
5
6
7
8
9
10
Next >>
[22]
428939
n/a
428940
n/a
495695
5-hydroxydecalin-1-one
495837
n/a
522416
11-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
525916
4-hydroxy-5-methyl-2-propan-2-yl-cyclohexan-1-one
internal high similarity DBLink | Rows returned: 3
JFD 02336
1.0000
SPE00100652
1.0000
SPE00270083
1.0000
active
| Cluster 883 | Additional Members: 1 | Rows returned: 0
Service provided by the
Mike Tyers Laboratory