COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186879
Chemical Name: N-{[5-({2-[(3-bromophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Smiles: C=CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1cccc(c1)Br

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Molecular Weight: 546.44
Empirical Formula: C23H24BrN5O4S

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 4.28
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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