COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK234985
Chemical Name: 3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-2-benzofuran-1(3H)-one
Smiles: OC1=C(C(=O)CC(C1)(C)C)C1OC(=O)c2c1cccc2

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Molecular Weight: 272.3
Empirical Formula: C16H16O4

Physical State: Dry powder
Available Amount: 384 mg

Lipinsky:
logP: 2.73
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 3

     

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