4-hydroxy-N-[(Z)-thiophen-3-ylmethylideneamino]benzamide
Molecular Formula : C12H10N2O2S | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |4-hydroxy-N-[(Z)-thiophen-3-ylmethylideneamino]benzamide is a drug-like molecule.
MolName : 4-hydroxy-N-[(Z)-thiophen-3-ylmethylideneamino]benzamide |
MolecularFormula : C12H10N2O2S |
Smiles : Oc(cc1)ccc1C(N/N=C\c1cscc1)=O |
InChI : InChI=1S/C12H10N2O2S/c15-11-3-1-10(2-4-11)12(16)14-13-7-9-5-6-17-8-9/h1-8,15H,(H,14,16) |
InChIK : UAUABLZVYGUWAJ-UHFFFAOYSA-N |
TotalMolweight : 246.289 |
Molweight : 246.289 |
MonoisotopicMass : 246.046298 |
CLogP : 2.6403 |
CLogS : -3.325 |
H Acceptors : 4 |
H Donors : 2 |
TotalSurfaceArea : 189.28 |
Relative PSA : 0.36702 |
PolarSurfaceArea : 89.93 |
Druglikeness : 4.8982 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde |
Shape Index : 0.70588 |
Fragments : 1 |
Non HAtoms : 17 |
NonCHAtoms : 5 |
Electronegative Atoms : 5 |
Rotatable Bond : 3 |
Rings Closures : 2 |
Small Rings : 2 |
Aromatic Rings : 2 |
Aromatic Atoms : 11 |
Sp3Atoms : 1 |
Symmetricatoms : 2 |
StereoCon : |