COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK044669
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-4-{1-[(thiophen-2-ylmethyl)amino]ethylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)SCC1=NN(C(=O)/C/1=C(\NCc1cccs1)/C)c1nc2c(s1)cccc2

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Molecular Weight: 490.67
Empirical Formula: C25H22N4OS3

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 6.747
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 139
Number of rings: 5

     

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