COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574057
Chemical Name: 2-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-3,6,6-trimethyl-6,7-dihydro-1-benzofuran-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)c1oc2c(c1C)C(=O)CC(C2)(C)C

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Molecular Weight: 400.9
Empirical Formula: C22H25ClN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.44
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 53
Number of rings: 4

     

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