COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685579
Chemical Name: phenylN-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-beta-alaninate
Smiles: O=C(Oc1ccccc1)CCNC1=C(Cl)C(=O)c2c(C1=O)cccc2

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Molecular Weight: 355.78
Empirical Formula: C19H14ClNO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.551
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 72
Number of rings: 3

     

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