COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK317670
Chemical Name: methyl2-{[({2-[3-(propan-2-yloxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OC(C)C)sc2c1CCCCC2

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Molecular Weight: 573.74
Empirical Formula: C31H31N3O4S2

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 9.032
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 149
Number of rings: 5

     

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