COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262054
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-4-{1-[(4-methylpiperazin-1-yl)amino]ethylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)C1=NN(C(=O)/C/1=C(\NN1CCN(CC1)C)/C)c1nc2c(s1)cccc2

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Molecular Weight: 462.58
Empirical Formula: C24H26N6O2S

Physical State: Dry powder
Available Amount: 408 mg

Lipinsky:
logP: 3.347
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 5

     

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