COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552521
Chemical Name: (2R,3'E,6'R)-7-chloro-3'-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methylidene)-4,6-dimethoxy-6'-methyl-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Smiles: COc1cc(CCN/C=C/2\C(=O)C[C@H]([C@@]3(C2=O)Oc2c(C3=O)c(OC)cc(c2Cl)OC)C)ccc1OC

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Molecular Weight: 529.97
Empirical Formula: C27H28ClNO8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.748
Rotatable bonds: 7
H-donors: 1
H-acceptors: 8
PSA: 109
Number of rings: 4

     

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