COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK771091
Chemical Name: ethyl{5-[(2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}butanoyl)amino]-1,3,4-thiadiazol-2-yl}acetate
Smiles: CCOC(=O)Cc1nnc(s1)NC(=O)C(Sc1nnc2c(n1)n(C(C)C)c1c2cccc1)CC

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Molecular Weight: 499.62
Empirical Formula: C22H25N7O3S2

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 4.27
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 178
Number of rings: 4

     

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