COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529817
Chemical Name: N-({4-phenyl-1-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-ylcarbonyl]piperidin-4-yl}carbonyl)-L-alanine
Smiles: OC(=O)[C@@H](NC(=O)C1(CCN(CC1)C(=O)[C@H]1NCc2c(C1)cccc2)c1ccccc1)C

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Saltdata: HCl
Molecular Weight: 435.52
Empirical Formula: C25H29N3O4

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 1.799
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 98
Number of rings: 4

     

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