COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109282
Chemical Name: N-{3-methyl-1-oxo-1-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]butan-2-yl}-1,3-benzodioxole-5-carboxamide(non-preferredname)
Smiles: CC(C(C(=O)N/N=C/c1cccs1)NC(=O)c1ccc2c(c1)OCO2)C

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Molecular Weight: 373.43
Empirical Formula: C18H19N3O4S

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 2.997
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 117
Number of rings: 3

     

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