COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL364869
Chemical Name: 2-({(E)-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1cc(ccc1c1ccc(o1)/C=N/c1sc2c(c1C#N)CCCC2)[N+](=O)[O-]

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Molecular Weight: 407.45
Empirical Formula: C21H17N3O4S

Physical State: Dry powder
Available Amount: 750 mg

Lipinsky:
logP: 4.474
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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