COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL156749
Chemical Name: 2'-(2-methoxyethyl)-1'-oxo-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: CCCc1n[nH]/c(=N\C(=O)C2c3ccccc3C(=O)N(C32CCCCC3)CCOC)/s1

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Molecular Weight: 442.58
Empirical Formula: C23H30N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.54
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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