COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207146
Chemical Name: 2-[(4-cyclohexyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethanone
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)CSc1nnc(n1C1CCCCC1)c1ccccc1

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Molecular Weight: 501.7
Empirical Formula: C29H35N5OS

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.691
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 79
Number of rings: 5

     

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