2-chloro-N-[(E)-3-morpholin-4-yl-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide
Molecular Formula : C19H18N3O3Cl | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |2-chloro-N-[(E)-3-morpholin-4-yl-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide is a drug-like molecule.
MolName : 2-chloro-N-[(E)-3-morpholin-4-yl-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide |
MolecularFormula : C19H18N3O3Cl |
Smiles : O=C(/C(/NC(c(cccc1)c1Cl)=O)=C\c1cnccc1)N1CCOCC1 |
InChI : InChI=1S/C19H18ClN3O3/c20-16-6-2-1-5-15(16)18(24)22-17(12-14-4-3-7-21-13-14)19(25)23-8-10-26-11-9-23/h1-7,12-13H,8-11H2,(H,22,24) |
InChIK : GVYTXZQSVOHGDN-UHFFFAOYSA-N |
TotalMolweight : 371.823 |
Molweight : 371.823 |
MonoisotopicMass : 371.103669 |
CLogP : 2.5557 |
CLogS : -3.012 |
H Acceptors : 6 |
H Donors : 1 |
TotalSurfaceArea : 280.71 |
Relative PSA : 0.22108 |
PolarSurfaceArea : 71.53 |
Druglikeness : 4.8888 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.46154 |
Fragments : 1 |
Non HAtoms : 26 |
NonCHAtoms : 7 |
Electronegative Atoms : 7 |
Rotatable Bond : 4 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 5 |
Symmetricatoms : 2 |
Amides : 2 |
Aromatic Nitrogens : 1 |
StereoCon : |