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Compound Information
SONAR Target prediction
Name:
CYCLOLEUCINE
Unique Identifier:
SPE01502128
MolClass:
Checkout models in
ver1.5
and
ver1.0
Molecular Formula:
Molecular Weight:
118.07 g/mol
X log p:
-2.117
(online calculus)
Lipinksi Failures
0
TPSA
17.07
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptors Count:
3
Rotatable Bond Count:
1
Canonical Smiles:
NC1(CCCC1)C(O)=O
Source:
synthetic
Therapeutics:
NMDA receptor antagonist (gly)
Generic_name:
NORLEUCINE
Chemical_iupac_name:
NORLEUCINE
Drug_type:
Experimental
Drugbank_id:
EXPT02355
Drug_category:
Phenylalanine-4-Hydroxylase inhibitor
Organisms_affected:
-1
Found: 205 nonactive as graph:
single
|
with analogs
1
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[205]
Species:
4932
Condition:
AAT2
Replicates:
2
Raw OD Value:
r
im
0.7479±0.0119501
Normalized OD Score:
sc
h
1.0180±0.00137791
Z-Score:
0.9529±0.0524906
p-Value:
0.340984
Z-Factor:
-2.58694
Fitness Defect:
1.0759
Bioactivity Statement:
Nonactive
Experimental Conditions
Library:
SPECMTS3
Plate Number and Position:
1|C4
Drug Concentration:
50.00 nM
OD Absorbance:
600 nm
Robot Temperature:
23.30 Celcius
Date:
2008-04-08 YYYY-MM-DD
Plate CH Control (+):
0.039975±0.00102
Plate DMSO Control (-):
0.7103±0.01415
Plate Z-Factor:
0.9224
png
ps
pdf
DBLink | Rows returned: 41
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456468
(2R)-2-aminohexanoic acid
517543
2-azaniumylhexanoate
519178
2-amino-3-cyclopropyl-propanoic acid
520755
2-amino-4-methyl-hexanoic acid
521918
2-amino-3-methyl-hexanoic acid
638969
(2R)-2-amino-2-[(1R,2R)-2-methylcyclopropyl]acetic acid
internal high similarity DBLink | Rows returned: 5
JFD 01160
0.9286
LOPAC 00333
0.9286
LOPAC 00681
0.9286
RJC 00670
0.9286
SB 02002
0.9286
active
| Cluster 4858 | Additional Members: 8 | Rows returned: 1
SPE01502131
0.2
Service provided by the
Mike Tyers Laboratory