COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL244098
Chemical Name: 2'-cyclopentyl-N-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Smiles: O=C(C1c2ccccc2C(=O)N(C21CCCCC2)C1CCCC1)/N=c/1\[nH]nc(s1)C

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Molecular Weight: 424.57
Empirical Formula: C23H28N4O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.963
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 5

     

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