COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600472
Chemical Name: N-{[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}-L-alanine
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)N[C@H](C(=O)O)C

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Molecular Weight: 402.42
Empirical Formula: C21H23FN2O5

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 2.913
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 88
Number of rings: 3

     

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