COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK423551
Chemical Name: methyl2-[({2-[4-(propan-2-yl)phenyl]quinolin-4-yl}carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCCCCCCCC2)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(C)C

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Molecular Weight: 568.78
Empirical Formula: C35H40N2O3S

Physical State: Dry powder
Available Amount: 1203 mg

Lipinsky:
logP: 12.353
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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