COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK745217
Chemical Name: N'-[(2E,3E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-ylidene]-3-chloro-1-benzothiophene-2-carbohydrazide
Smiles: C/C(=N\NC(=O)c1sc2c(c1Cl)cccc2)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 398.87
Empirical Formula: C20H15ClN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.342
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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