COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL348403
Chemical Name: methyl2-{[{(2E)-2-[(3E)-4-ethoxy-3-(hydroxyimino)-4-oxobutan-2-ylidene]hydrazinyl}(oxo)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)/C(=N/O)/C(=N/NC(=O)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2)/C

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Molecular Weight: 438.46
Empirical Formula: C18H22N4O7S

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 4.437
Rotatable bonds: 9
H-donors: 3
H-acceptors: 7
PSA: 183
Number of rings: 2

     

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