COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL485496
Chemical Name: N-cyclohexyl-N~2~-{[3-(1-methyl-1H-pyrrol-2-yl)-1-oxo-2-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinolin-4-yl]methyl}valinamide
Smiles: CC(C(C(=O)NC1CCCCC1)NCC1c2ccccc2C(=O)N(C1c1cccn1C)CCc1ccccc1)C

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Molecular Weight: 540.75
Empirical Formula: C34H44N4O2

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 5.165
Rotatable bonds: 9
H-donors: 2
H-acceptors: 2
PSA: 66
Number of rings: 5

     

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