COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL021060
Chemical Name: 4-(2-aminoethyl)-3-(3-chlorophenyl)-5-oxo-2,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: NCCc1c([nH]n(c1=O)C(=S)N)c1cccc(c1)Cl

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Saltdata: H2SO4
Molecular Weight: 296.78
Empirical Formula: C12H13ClN4OS

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 1.768
Rotatable bonds: 3
H-donors: 5
H-acceptors: 1
PSA: 116
Number of rings: 2

     

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