COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK497510
Chemical Name: N-{[4-ethyl-5-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-1,3-benzodioxole-5-carboxamide
Smiles: CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCC(=O)Nc1cc(C)ccc1OC

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Molecular Weight: 483.55
Empirical Formula: C23H25N5O5S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 141
Number of rings: 4

     

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