COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261111
Chemical Name: 2-{[5-(morpholin-4-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: C=CCn1c(SCC(=O)N2CCN(CC2)c2ccccc2)nnc1CN1CCOCC1

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Molecular Weight: 442.59
Empirical Formula: C22H30N6O2S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 2.324
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 92
Number of rings: 4

     

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