COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK536705
Chemical Name: 2-chloro-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}naphthalene-1,4-dione
Smiles: COc1cc(CCNC2=C(Cl)C(=O)c3c(C2=O)cccc3)ccc1OC

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Molecular Weight: 371.82
Empirical Formula: C20H18ClNO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.718
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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