COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK103384
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(pyridin-4-yl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C(/c1ccncc1)\C

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Molecular Weight: 498.65
Empirical Formula: C28H30N6OS

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 7.093
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 110
Number of rings: 4

     

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