2-chloro-N-[(Z)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C20H18N3O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-chloro-N-[(Z)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	2-chloro-N-[(Z)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C20H18N3O5Cl
Smiles	[O-][N+](c1cccc(/C=C(/C(N2CCOCC2)=O)\NC(c(cccc2)c2Cl)=O)c1)=O
InChI	InChI=1S/C20H18ClN3O5/c21-17-7-2-1-6-16(17)19(25)22-18(20(26)23-8-10-29-11-9-23)13-14-4-3-5-15(12-14)24(27)28/h1-7,12-13H,8-11H2,(H,22,25)
InChIK	GOGBLXLZNLTHLO-UHFFFAOYSA-N
TotalMolweight	415.832
Molweight	415.832
MonoisotopicMass	415.093499
CLogP	2.635
CLogS	-4.267
H Acceptors	8
H Donors	1
TotalSurfaceArea	305.62
Relative PSA	0.2667
PolarSurfaceArea	104.46
Druglikeness	-0.13815
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.44828
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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