COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400765
Chemical Name: N-(2-chloro-5-nitrophenyl)-2-({5-[3-(2,4-dichlorophenoxy)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: C=CCn1c(CCCOc2ccc(cc2Cl)Cl)nnc1SCC(=O)Nc1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 556.86
Empirical Formula: C22H20Cl3N5O4S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 6.642
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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