COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK132969
Chemical Name: 2-{[5-(4-methoxybenzyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: COc1ccc(cc1)Cc1nnc(n1CC=C)SCC(=O)N1CCN(CC1)c1ccccc1

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Molecular Weight: 463.6
Empirical Formula: C25H29N5O2S

Physical State: Dry powder
Available Amount: 601 mg

Lipinsky:
logP: 4.059
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 4

     

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