COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL231834
Chemical Name: methyl2-({[1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CN2CCC3(C(C2c2ccc(cc2)F)CCCC3)O)sc2c1CCCC2

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Molecular Weight: 500.63
Empirical Formula: C27H33FN2O4S

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 6.203
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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