N-[(E)-3-(benzylamino)-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide

Formula:C21H18N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(E)-3-(benzylamino)-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide is a drug-like molecule.

MolName	N-[(E)-3-(benzylamino)-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
MolecularFormula	C21H18N2O4
Smiles	Oc1ccc(/C=C(\C(NCc2ccccc2)=O)/NC(c2ccco2)=O)cc1
InChI	InChI=1S/C21H18N2O4/c24-17-10-8-15(9-11-17)13-18(23-21(26)19-7-4-12-27-19)20(25)22-14-16-5-2-1-3-6-16/h1-13,24H,14H2,(H,22,25)(H,23,26)
InChIK	VSMBRJQWKLGHSU-UHFFFAOYSA-N
TotalMolweight	362.384
Molweight	362.384
MonoisotopicMass	362.126658
CLogP	2.9762
CLogS	-4.075
H Acceptors	6
H Donors	3
TotalSurfaceArea	285.71
Relative PSA	0.26674
PolarSurfaceArea	91.57
Druglikeness	3.2979
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	4
Amides	2
StereoCon

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