COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186729
Chemical Name: 3,4-dichloro-N-{2-[4-ethyl-5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Smiles: CCn1c(CCNC(=O)c2ccc(c(c2)Cl)Cl)nnc1SCC(=O)Nc1ccc(c(c1)[N+](=O)[O-])C

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Molecular Weight: 537.43
Empirical Formula: C22H22Cl2N6O4S

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 5.496
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 3

     

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