COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319806
Chemical Name: (4a-hydroxyoctahydroisoquinolin-2(1H)-yl){1-[(4-methoxyphenyl)sulfonyl]piperidin-4-yl}methanone
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCC2(C(C1)CCCC2)O

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Molecular Weight: 436.57
Empirical Formula: C22H32N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.048
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 95
Number of rings: 4

     

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