2-chloro-N-[(E)-3-morpholin-4-yl-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide

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.

MolName2-chloro-N-[(E)-3-morpholin-4-yl-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]benzamide
MolecularFormulaC19H18N3O3Cl
SmilesO=C(/C(/NC(c(cccc1)c1Cl)=O)=C\c1cnccc1)N1CCOCC1
InChIInChI=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)
InChIKGVYTXZQSVOHGDN-UHFFFAOYSA-N
TotalMolweight371.823
Molweight371.823
MonoisotopicMass371.103669
CLogP2.5557
CLogS-3.012
H Acceptors6
H Donors1
TotalSurfaceArea280.71
Relative PSA0.22108
PolarSurfaceArea71.53
Druglikeness4.8888
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.46154
Fragments1
Non HAtoms26
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms2
Amides2
Aromatic Nitrogens1
StereoCon

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