COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK658672
Chemical Name: 3-({trans-4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)carbonyl]cyclohexyl}methyl)-1,2,3-benzotriazin-4(3H)-one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)[C@@H]1CC[C@H](CC1)Cn1nnc2c(c1=O)cccc2

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Molecular Weight: 462.55
Empirical Formula: C26H30N4O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.457
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 5

     

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