COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006230
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-5-phenyl-4-[({[1-(phenylcarbonyl)piperidin-4-yl]methyl}amino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=C\NCC1CCN(CC1)C(=O)c1ccccc1)c1ccccc1)c1nc2c(s1)cccc2

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Molecular Weight: 521.64
Empirical Formula: C30H27N5O2S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.422
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 106
Number of rings: 6

     

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