COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587318
Chemical Name: (3S)-N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: O=C([C@H]1NCc2c(C1)cccc2)N[C@H](C(=O)Nc1ccc2c(c1)OCO2)C(C)C

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Saltdata: HCl
Molecular Weight: 395.46
Empirical Formula: C22H25N3O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.56
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 88
Number of rings: 4

     

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