COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL245149
Chemical Name: 2'-(butan-2-yl)-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: COCc1n[nH]/c(=N\C(=O)C2c3ccccc3C(=O)N(C32CCCCC3)C(CC)C)/s1

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Molecular Weight: 442.58
Empirical Formula: C23H30N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 2.719
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 108
Number of rings: 4

     

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