COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK038360
Chemical Name: methyl4-(6-bromo-1,3-benzodioxol-5-yl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1cc3OCOc3cc1Br)C(=O)CC(C2)c1ccc(cc1)Cl

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Molecular Weight: 530.8
Empirical Formula: C25H21BrClNO5

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.67
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 5

     

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