COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562735
Chemical Name: (1S,2Z,5R)-2-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}ethylidene)-6,6-dimethylbicyclo[3.1.0]hexan-3-one
Smiles: COc1cc(CCN/C(=C/2\C(=O)C[C@@H]3[C@H]2C3(C)C)/C)ccc1OC

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Molecular Weight: 329.44
Empirical Formula: C20H27NO3

Available Amount: 0 mg

Lipinsky:
logP: 3.48
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 3

     

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