COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK297783
Chemical Name: N-{[4-ethyl-5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)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)Nc1nnc(s1)C

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Molecular Weight: 461.53
Empirical Formula: C18H19N7O4S2

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 1.115
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 186
Number of rings: 4

     

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