COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552256
Chemical Name: 2-{4-[(2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[3]en]-4'-yl]piperazin-1-yl}pyridine-3-carbonitrile
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)N1CCN(CC1)c1ncccc1C#N)Cl

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Molecular Weight: 508.96
Empirical Formula: C26H25ClN4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.897
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 104
Number of rings: 5

     

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