COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK755563
Chemical Name: 2-methoxy-N-[(E)-{3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl}methylidene]aniline
Smiles: COc1ccccc1/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 466.5
Empirical Formula: C21H14N4O5S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.827
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 179
Number of rings: 4

     

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