COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL530076
Chemical Name: methylN-{[4a-hydroxy-1-(2-methoxyphenyl)octahydroisoquinolin-2(1H)-yl]acetyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)CN1CCC2(C(C1c1ccccc1OC)CCCC2)O

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Molecular Weight: 519.64
Empirical Formula: C30H37N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.332
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 103
Number of rings: 5

     

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