benzyl (E)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate

Formula:C23H19NO4 Mutagenic:high Tumorigenic:none Reproductive Effective:none benzyl (E)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate is a drug-like molecule.

MolNamebenzyl (E)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate
MolecularFormulaC23H19NO4
SmilesO=C(/C=C/c1ccccc1)N/C(/C(OCc1ccccc1)=O)=C/c1ccco1
InChIInChI=1S/C23H19NO4/c25-22(14-13-18-8-3-1-4-9-18)24-21(16-20-12-7-15-27-20)23(26)28-17-19-10-5-2-6-11-19/h1-16H,17H2,(H,24,25)
InChIKURIWYXDVPSRHOP-UHFFFAOYSA-N
TotalMolweight373.407
Molweight373.407
MonoisotopicMass373.131409
CLogP4.1253
CLogS-4.877
H Acceptors5
H Donors1
TotalSurfaceArea304.4
Relative PSA0.20253
PolarSurfaceArea68.54
Druglikeness1.0162
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.57143
Fragments1
Non HAtoms28
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms4
Amides1
StereoCon

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