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Compound InformationSONAR Target prediction
Name:

L-N5-(1-Iminoethyl)ornithine hydrochloride

Unique Identifier:LOPAC 00441
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C7ClH16N3O2
Molecular Weight:194.555 g/mol
X log p:-2.295  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:6
Canonical Smiles:Cl.CC(=N)NCCCC(N)C(O)=O
Class:Nitric Oxide
Action:Inhibitor
Selectivity:NOS
Generic_name:N5-IMINOETHYL-L-ORNITHINE
Chemical_iupac_name:N5-IMINOETHYL-L-ORNITHINE
Drug_type:Experimental
Drugbank_id:EXPT01862
Drug_category:Nitric Oxide Synthase inhibitor
Organisms_affected:-1

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: SAP30
Replicates: 2
Raw OD Value: r im 0.8258±0.00777817
Normalized OD Score: sc h 1.0179±0.00173591
Z-Score: 1.5534±0.248942
p-Value: 0.126074
Z-Factor: -4.95722
Fitness Defect: 2.0709
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:9|E4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.20 Celcius
Date:2005-11-18 YYYY-MM-DD
Plate CH Control (+):0.039400000000000004±0.00728
Plate DMSO Control (-):0.783075±0.01440
Plate Z-Factor:0.9376
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 4071 | Additional Members: 12 | Rows returned: 91 2 Next >> 
LOPAC 00681 0.5
LOPAC 01348 0.384615384615385
LOPAC 00411 0.333333333333333
SPE01502194 0.333333333333333
LOPAC 00447 0.333333333333333
LOPAC 00422 0.333333333333333

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