COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK984502
Chemical Name: 4-{[(2Z)-4-(3,4-dichlorophenyl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: C=CCn1/c(=N/c2c(C)n(n(c2=O)c2ccccc2)C)/scc1c1ccc(c(c1)Cl)Cl

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Saltdata: HBr
Molecular Weight: 471.41
Empirical Formula: C23H20Cl2N4OS

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 5.297
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 64
Number of rings: 4

     

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