COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK907076
Chemical Name: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(furan-2-yl)-3-hydroxy-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1)c1ccco1)C(=O)c1cccs1)O

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Saltdata: 1/4CH3COOH
Molecular Weight: 481.58
Empirical Formula: C22H15N3O4S3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.657
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 178
Number of rings: 5

     

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