COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL241415
Chemical Name: N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)N[C@H](C(=O)Nc1ccc2c(c1)OCCO2)C(C)C

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Molecular Weight: 469.54
Empirical Formula: C25H31N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.669
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 98
Number of rings: 4

     

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