(E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide

Formula:C21H26N2O4 Mutagenic:high Tumorigenic:none Reproductive Effective:none (E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide is a drug-like molecule.

MolName(E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide
MolecularFormulaC21H26N2O4
SmilesO=C(/C=C/c1ccco1)NCCCCCCCNC(/C=C/c1ccco1)=O
InChIInChI=1S/C21H26N2O4/c24-20(12-10-18-8-6-16-26-18)22-14-4-2-1-3-5-15-23-21(25)13-11-19-9-7-17-27-19/h6-13,16-17H,1-5,14-15H2,(H,22,24)(H,23,25)
InChIKYUKYTDWYGHOFQQ-UHFFFAOYSA-N
TotalMolweight370.447
Molweight370.447
MonoisotopicMass370.189258
CLogP3.34
CLogS-4.312
H Acceptors6
H Donors2
TotalSurfaceArea320.14
Relative PSA0.24121
PolarSurfaceArea84.48
Druglikeness-6.0265
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.77778
Fragments1
Non HAtoms27
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond12
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms7
Symmetricatoms13
Amides2
StereoCon

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