COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376815
Chemical Name: 2-{[4-(4-chlorophenyl)-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)N2CCN(CC2)c2ccccc2)nnc1CN1CCOCC1

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Molecular Weight: 513.06
Empirical Formula: C25H29ClN6O2S

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 4.242
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 92
Number of rings: 5

     

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