4-[[(E)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]butanoic acid

Formula:C18H18N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[[(E)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]butanoic acid is a drug-like molecule.

MolName	4-[[(E)-2-(furan-2-carbonylamino)-3-phenylprop-2-enoyl]amino]butanoic acid
MolecularFormula	C18H18N2O5
Smiles	OC(CCCNC(/C(/NC(c1ccco1)=O)=C\c1ccccc1)=O)=O
InChI	InChI=1S/C18H18N2O5/c21-16(22)9-4-10-19-17(23)14(12-13-6-2-1-3-7-13)20-18(24)15-8-5-11-25-15/h1-3,5-8,11-12H,4,9-10H2,(H,19,23)(H,20,24)(H,21,22)
InChIK	OZNRFGVHNOWTGD-UHFFFAOYSA-N
TotalMolweight	342.35
Molweight	342.35
MonoisotopicMass	342.121573
CLogP	1.9426
CLogS	-3.363
H Acceptors	7
H Donors	3
TotalSurfaceArea	271.22
Relative PSA	0.32907
PolarSurfaceArea	108.64
Druglikeness	1.2409
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	4
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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