COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK934247
Chemical Name: N-[(2Z)-5-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-2-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Smiles: CCCCc1n[nH]/c(=N/C(=O)C2c3ccccc3C(=O)N(C2c2ccccc2)C)/s1

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Molecular Weight: 420.54
Empirical Formula: C23H24N4O2S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.885
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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