COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602027
Chemical Name: (3S)-N-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Smiles: CC([C@H](C(=O)Nc1ccc2c(c1)OCCO2)NC(=O)[C@H]1NCc2c(C1)cccc2)C

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Saltdata: HCl
Molecular Weight: 409.49
Empirical Formula: C23H27N3O4

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 2.369
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 88
Number of rings: 4

     

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