COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150095
Chemical Name: (4Z)-4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: N/C=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)c1ccccc1

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Molecular Weight: 320.37
Empirical Formula: C17H12N4OS

Physical State: Dry powder
Available Amount: 373 mg

Lipinsky:
logP: 3.016
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 99
Number of rings: 4

     

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