COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758386
Chemical Name: methyl2-[2-amino-4-(4-chlorophenyl)-3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(cc1)Cl)C(=O)CCC2)c1sc2c(c1C(=O)OC)CCCCC2

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Molecular Weight: 508.04
Empirical Formula: C27H26ClN3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.987
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 124
Number of rings: 5

     

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