COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK579164
Chemical Name: (3S)-N-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@@H](c1ccccc1)NC(=O)[C@H]1NCc2c(C1)cccc2)Nc1ccc2c(c1)OCCO2

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Saltdata: HCl
Molecular Weight: 443.5
Empirical Formula: C26H25N3O4

Physical State: Dry powder
Available Amount: 246 mg

Lipinsky:
logP: 2.943
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 88
Number of rings: 5

     

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