COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206703
Chemical Name: 4-[2-({[4-(4-methoxyphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazine-1-carboxamide
Smiles: COc1ccc(cc1)C1CC(=O)/C(=C/NCCN2CCN(CC2)C(=O)NC23CC4CC(C3)CC(C2)C4)/C(=O)C1

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Molecular Weight: 534.7
Empirical Formula: C31H42N4O4

Physical State: Dry powder
Available Amount: 353 mg

Lipinsky:
logP: 3.572
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 90
Number of rings: 7

     

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