COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL561332
Chemical Name: 3-[(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)carbonyl]-1H-isothiochromen-1-one
Smiles: O=C(c1cc2ccccc2c(=O)s1)N1CCC2(C(C1)CCCC2)O

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Molecular Weight: 343.45
Empirical Formula: C19H21NO3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.658
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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