COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL497783
Chemical Name: 6,8,8,9-tetramethyl-3-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-6,7,8,9-tetrahydro-2H-pyrano[3,2-g]quinolin-2-one
Smiles: O=C(c1cc2cc3C(C)CC(N(c3cc2oc1=O)C)(C)C)CSc1nncn1C

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Molecular Weight: 412.51
Empirical Formula: C21H24N4O3S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 4.474
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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