COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834958
Chemical Name: (2E)-3-[(3-butoxyphenyl)amino]-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1ccc(cc1)CC(C)C)\C#N

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Molecular Weight: 431.6
Empirical Formula: C26H29N3OS

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 8.076
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 86
Number of rings: 3

     

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