COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671797
Chemical Name: 3-[(E)-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl]phenyl3,5-dinitrobenzoate
Smiles: Oc1ccc(cc1c1nc2c(s1)cccc2)/N=C/c1cccc(c1)OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 540.51
Empirical Formula: C27H16N4O7S

Physical State: Dry powder
Available Amount: 7 mg

Lipinsky:
logP: 6.729
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 191
Number of rings: 5

     

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