COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK469018
Chemical Name: (2E)-4-({4-[(1Z)-1-{2-[(2,4-dimethoxyphenyl)sulfonyl]hydrazinylidene}ethyl]phenyl}amino)-4-oxobut-2-enoicacid
Smiles: COc1cc(OC)ccc1S(=O)(=O)N/N=C(\c1ccc(cc1)NC(=O)/C=C/C(=O)O)/C

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Molecular Weight: 447.47
Empirical Formula: C20H21N3O7S

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 2.6
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 151
Number of rings: 2

     

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