COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK424657
Chemical Name: 4-({4-[(1E)-1-{2-[(3-chloro-1-benzothiophen-2-yl)carbonyl]hydrazinylidene}ethyl]phenyl}amino)-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)Nc1ccc(cc1)/C(=N/NC(=O)c1sc2c(c1Cl)cccc2)/C

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Molecular Weight: 443.91
Empirical Formula: C21H18ClN3O4S

Physical State: Dry powder
Available Amount: 1788 mg

Lipinsky:
logP: 4.344
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 136
Number of rings: 3

     

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