COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002224
Chemical Name: tetrahydrofuran-2-ylmethyl4-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1cc(cc(c1O)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCC1CCCO1

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Molecular Weight: 475.97
Empirical Formula: C25H30ClNO6

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 2.467
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 94
Number of rings: 4

     

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