6-[[(E)-2-benzamido-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid

Formula:C20H22N2O5 Mutagenic:high Tumorigenic:none Reproductive Effective:none 6-[[(E)-2-benzamido-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid is a drug-like molecule.

MolName	6-[[(E)-2-benzamido-3-(furan-2-yl)prop-2-enoyl]amino]hexanoic acid
MolecularFormula	C20H22N2O5
Smiles	OC(CCCCCNC(/C(/NC(c1ccccc1)=O)=C\c1ccco1)=O)=O
InChI	InChI=1S/C20H22N2O5/c23-18(24)11-5-2-6-12-21-20(26)17(14-16-10-7-13-27-16)22-19(25)15-8-3-1-4-9-15/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H,21,26)(H,22,25)(H,23,24)
InChIK	WDOCAZSGXBOAKQ-UHFFFAOYSA-N
TotalMolweight	370.404
Molweight	370.404
MonoisotopicMass	370.152873
CLogP	2.8514
CLogS	-3.903
H Acceptors	7
H Donors	3
TotalSurfaceArea	298.74
Relative PSA	0.29875
PolarSurfaceArea	108.64
Druglikeness	-7.5536
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	6
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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