COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230646
Chemical Name: N-[(5-{[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-4-chlorobenzamide
Smiles: CCn1c(nnc1CNC(=O)c1ccc(cc1)Cl)SC(C(=O)Nc1ccc2c(c1)OCO2)C

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Molecular Weight: 487.97
Empirical Formula: C22H22ClN5O4S

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 4.313
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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