COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL001176
Chemical Name: 2-chloro-3-({methyl[4-(tetradecyloxy)phenyl]amino}methyl)naphthalene-1,4-dione
Smiles: CCCCCCCCCCCCCCOc1ccc(cc1)N(CC1=C(Cl)C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 524.14
Empirical Formula: C32H42ClNO3

Physical State: Dry powder
Available Amount: 1540 mg

Lipinsky:
logP: 10.468
Rotatable bonds: 15
H-donors: 0
H-acceptors: 3
PSA: 46
Number of rings: 3

     

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