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Compound InformationSONAR Target prediction
Name:

Semicarbazide hydrochloride

Unique Identifier:LOPAC 00637
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:CClH6N3O
Molecular Weight:105.483 g/mol
X log p:-0.434  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Cl.NNC(N)=O
Class:Neurotransmission
Action:Inhibitor
Selectivity:MAO

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: PAC10
Replicates: 2
Raw OD Value: r im 0.7455±0.00360624
Normalized OD Score: sc h 0.9987±0.00212517
Z-Score: -0.0587±0.0958925
p-Value: 0.946032
Z-Factor: -12.895
Fitness Defect: 0.0555
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:14|F7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.60 Celcius
Date:2005-04-15 YYYY-MM-DD
Plate CH Control (+):0.047775±0.00108
Plate DMSO Control (-):0.7048750000000001±0.01177
Plate Z-Factor:0.9424
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DBLink | Rows returned: 3
5196 aminourea
11236 aminourea hydrochloride
4428096 (carbamoylamino)azanium

internal high similarity DBLink | Rows returned: 0

active | Cluster 585 | Additional Members: 3 | Rows returned: 2
LOPAC 00959 0
SPE01500344 0

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