COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL008819
Chemical Name: butyl4-(3-iodophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)I)C(=O)CC(C2)(C)C

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Molecular Weight: 493.38
Empirical Formula: C23H28INO3

Available Amount: 0 mg

Lipinsky:
logP: 5.302
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 3

     

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