2-[[(Z)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid

Formula:C23H20N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[(Z)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid is a drug-like molecule.

MolName	2-[[(Z)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid
MolecularFormula	C23H20N2O5
Smiles	OC(C(Cc1ccccc1)NC(/C(/NC(c1ccco1)=O)=C/c1ccccc1)=O)=O
InChI	InChI=1S/C23H20N2O5/c26-21(25-19(23(28)29)15-17-10-5-2-6-11-17)18(14-16-8-3-1-4-9-16)24-22(27)20-12-7-13-30-20/h1-14,19H,15H2,(H,24,27)(H,25,26)(H,28,29)/t19-/m0/s1
InChIK	YCIJGUHRLATMSH-IBGZPJMESA-N
TotalMolweight	404.421
Molweight	404.421
MonoisotopicMass	404.137223
CLogP	2.835
CLogS	-4.336
H Acceptors	7
H Donors	3
TotalSurfaceArea	315.96
Relative PSA	0.28247
PolarSurfaceArea	108.64
Druglikeness	-7.631
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	4
Amides	2
AcidicOxygens	1
StereoCon	racemate

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1 - 2-[[(Z)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid | 2 - 2-[[(Z)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid

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