COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK232015
Chemical Name: (4Z)-2-(4-methoxyphenyl)-5-methyl-4-(1-{[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}ethylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)N1N=C(/C(=C(/Nc2ccc(cc2)Cn2cncn2)\C)/C1=O)C

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Molecular Weight: 402.46
Empirical Formula: C22H22N6O2

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 1.576
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 4

     

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