COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK748517
Chemical Name: 3,4-dimethyl-N-[(E)-{5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]furan-2-yl}methylidene]aniline
Smiles: [O-][N+](=O)c1ccc2c(c1)sc(n2)Sc1ccc(o1)/C=N/c1ccc(c(c1)C)C

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Molecular Weight: 409.49
Empirical Formula: C20H15N3O3S2

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 5.692
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 137
Number of rings: 4

     

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