COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385933
Chemical Name: (2E)-N-(1,3-benzothiazol-2-yl)-3-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1c(C)nn(c1Cl)c1ccccc1)/C(=O)Nc1nc2c(s1)cccc2

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Molecular Weight: 419.89
Empirical Formula: C21H14ClN5OS

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 5.262
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 111
Number of rings: 4

     

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