COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK849646
Chemical Name: N-[(2E)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-7-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Smiles: CCSc1n[nH]/c(=N\C(=O)C2OC(=O)c3c(C2)ccc(c3)C)/s1

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Molecular Weight: 349.43
Empirical Formula: C15H15N3O3S2

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 2.196
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 3

     

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