benzyl 3-[[(Z)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoate

Formula:C24H21N3O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none benzyl 3-[[(Z)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoate is a drug-like molecule.

MolName	benzyl 3-[[(Z)-2-(furan-2-carbonylamino)-3-(3-nitrophenyl)prop-2-enoyl]amino]propanoate
MolecularFormula	C24H21N3O7
Smiles	[O-][N+](c1cc(/C=C(/C(NCCC(OCc2ccccc2)=O)=O)\NC(c2ccco2)=O)ccc1)=O
InChI	InChI=1S/C24H21N3O7/c28-22(34-16-17-6-2-1-3-7-17)11-12-25-23(29)20(26-24(30)21-10-5-13-33-21)15-18-8-4-9-19(14-18)27(31)32/h1-10,13-15H,11-12,16H2,(H,25,29)(H,26,30)
InChIK	CQVKHEJDMTUBJB-UHFFFAOYSA-N
TotalMolweight	463.445
Molweight	463.445
MonoisotopicMass	463.137952
CLogP	2.4126
CLogS	-5.004
H Acceptors	10
H Donors	2
TotalSurfaceArea	358.3
Relative PSA	0.32534
PolarSurfaceArea	143.46
Druglikeness	-2.6772
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	11
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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