COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177516
Chemical Name: (2E)-2-[(4-benzylpiperazin-1-yl)carbonyl]-3-{2-[(4-bromobenzyl)oxy]naphthalen-1-yl}prop-2-enenitrile
Smiles: N#C/C(=C\c1c(OCc2ccc(cc2)Br)ccc2c1cccc2)/C(=O)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 566.5
Empirical Formula: C32H28BrN3O2

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 6.48
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 56
Number of rings: 5

     

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