COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541799
Chemical Name: 4-butyl-7-({1-[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-1-oxopropan-2-yl}oxy)-2H-chromen-2-one
Smiles: CCCCc1cc(=O)oc2c1ccc(c2)OC(C(=O)N1CC[C@@]2([C@H](C1)CCCC2)O)C

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Molecular Weight: 427.54
Empirical Formula: C25H33NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.267
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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