2-[[(Z)-2-(furan-2-carbonylamino)-3-(furan-2-yl)prop-2-enoyl]amino]acetate

Formula:C14H11N2O6 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[[(Z)-2-(furan-2-carbonylamino)-3-(furan-2-yl)prop-2-enoyl]amino]acetate is a drug-like molecule.

MolName2-[[(Z)-2-(furan-2-carbonylamino)-3-(furan-2-yl)prop-2-enoyl]amino]acetate
MolecularFormulaC14H11N2O6
Smiles[O-]C(CNC(/C(/NC(c1ccco1)=O)=C/c1ccco1)=O)=O
InChIInChI=1S/C14H12N2O6/c17-12(18)8-15-13(19)10(7-9-3-1-5-21-9)16-14(20)11-4-2-6-22-11/h1-7H,8H2,(H,15,19)(H,16,20)(H,17,18)/p-1
InChIKAYTAMHBTFHWZJF-UHFFFAOYSA-M
TotalMolweight303.249
Molweight303.249
MonoisotopicMass303.061713
CLogP-1.8535
CLogS-2.505
H Acceptors8
H Donors2
TotalSurfaceArea234.57
Relative PSA0.44567
PolarSurfaceArea124.61
Druglikeness1.268
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms22
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms2
Amides2
AcidicOxygens1
StereoCon

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