COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535065
Chemical Name: 6,7-dimethoxy-1-(4-methoxyphenyl)-N-[(2S)-1-oxo-1-(prop-2-en-1-ylamino)propan-2-yl]-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: C=CCNC(=O)[C@@H](NC(=O)N1CCc2c(C1c1ccc(cc1)OC)cc(c(c2)OC)OC)C

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Molecular Weight: 453.54
Empirical Formula: C25H31N3O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.908
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 89
Number of rings: 3

     

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