COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK778199
Chemical Name: 3-bromo-N-{(1Z)-1-(4-methoxyphenyl)-3-oxo-3-[(1,2,3,4-tetrahydroisoquinolin-1-ylmethyl)amino]prop-1-en-2-yl}benzamide
Smiles: COc1ccc(cc1)/C=C(/C(=O)NCC1NCCc2c1cccc2)\NC(=O)c1cccc(c1)Br

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Molecular Weight: 520.43
Empirical Formula: C27H26BrN3O3

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 3.866
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 79
Number of rings: 4

     

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