Home
|
Screening data
|
Screen comparisons
|
Search for compounds
|
Structure search
Compound Information
SONAR Target prediction
Name:
AMBRETTOLIDE
Unique Identifier:
SPE00310003
MolClass:
Checkout models in
ver1.5
and
ver1.0
Molecular Formula:
C16H28O2
Molecular Weight:
224.17 g/mol
X log p:
4.152
(online calculus)
Lipinksi Failures
0
TPSA
26.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptors Count:
2
Rotatable Bond Count:
0
Canonical Smiles:
O=C1CCCCCC=CCCCCCCCCO1
Source:
ex Abelmoschus moschatus and bees
Reference:
Food Cosmet Toxicol 13: 707 (1975)
Found: 101 nonactive as graph:
single
|
with analogs
[1]
<< Back
21
22
23
24
25
26
27
28
29
30
Next >>
[101]
Species:
4932
Condition:
COT1
Replicates:
2
Raw OD Value:
r
im
0.6877±0.00417193
Normalized OD Score:
sc
h
0.9985±0.00119759
Z-Score:
-0.0758±0.0611118
p-Value:
0.939628
Z-Factor:
-78.7569
Fitness Defect:
0.0623
Bioactivity Statement:
Nonactive
Experimental Conditions
Library:
Spectrum
Plate Number and Position:
23|E11
Drug Concentration:
50.00 nM
OD Absorbance:
600 nm
Robot Temperature:
26.20 Celcius
Date:
2007-11-20 YYYY-MM-DD
Plate CH Control (+):
0.039825±0.00056
Plate DMSO Control (-):
0.675975±0.01632
Plate Z-Factor:
0.9265
png
ps
pdf
DBLink | Rows returned: 136
[1]
<< Back
11
12
13
14
15
16
17
18
19
20
Next >>
[23]
6044827
heptadecyl (E)-octadec-9-enoate
6044828
tridecyl (E)-octadec-9-enoate
6044893
octyl (E)-octadec-9-enoate
6087269
[(E)-octadec-9-enyl] octadecanoate
6087858
octadecyl (E)-octadec-9-enoate
6110549
[(E)-octadec-9-enyl] (E)-octadec-9-enoate
internal high similarity DBLink | Rows returned: 5
SPE00100552
0.9123
SPE00102058
0.9180
NRB 03689
0.9194
SPE00300034
0.9194
SPE00310017
0.9474
active
| Cluster 983 | Additional Members: 1 | Rows returned: 0
Service provided by the
Mike Tyers Laboratory