COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK482917
Chemical Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-({5-[3-(4-chloro-2-methylphenoxy)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(CCCOc2ccc(cc2C)Cl)nnc1SCC(=O)Nc1cc(OC)c(cc1OC)Cl

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Molecular Weight: 551.49
Empirical Formula: C25H28Cl2N4O4S

Physical State: Dry powder
Available Amount: 642 mg

Lipinsky:
logP: 7.169
Rotatable bonds: 12
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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