COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535744
Chemical Name: 3-[2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-hydroxy-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)CC1NC(=O)c2c(N=C1O)cccc2

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Molecular Weight: 409.44
Empirical Formula: C22H23N3O5

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 0.442
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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