2-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoyl]amino]benzoate

Formula:C21H15N2O5 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoyl]amino]benzoate is a drug-like molecule.

MolName	2-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoyl]amino]benzoate
MolecularFormula	C21H15N2O5
Smiles	[O-]C(c(cccc1)c1NC(c1cc(NC(/C=C/c2ccco2)=O)ccc1)=O)=O
InChI	InChI=1S/C21H16N2O5/c24-19(11-10-16-7-4-12-28-16)22-15-6-3-5-14(13-15)20(25)23-18-9-2-1-8-17(18)21(26)27/h1-13H,(H,22,24)(H,23,25)(H,26,27)/p-1
InChIK	OJLSHCIZPDKONY-UHFFFAOYSA-M
TotalMolweight	375.359
Molweight	375.359
MonoisotopicMass	375.098098
CLogP	0.8816
CLogS	-4.705
H Acceptors	7
H Donors	2
TotalSurfaceArea	292.67
Relative PSA	0.30898
PolarSurfaceArea	111.47
Druglikeness	-0.051794
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoyl]amino]benzoate | 2 - 2-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoyl]amino]benzoate

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