N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-2-iodobenzohydrazide

Formula:C16H12N2O2FI Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-2-iodobenzohydrazide is a drug-like molecule.

MolNameN'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-2-iodobenzohydrazide
MolecularFormulaC16H12N2O2FI
SmilesO=C(/C=C/c(cc1)ccc1F)NNC(c(cccc1)c1I)=O
InChIInChI=1S/C16H12FIN2O2/c17-12-8-5-11(6-9-12)7-10-15(21)19-20-16(22)13-3-1-2-4-14(13)18/h1-10H,(H,19,21)(H,20,22)
InChIKHYHUNLSLNFHMGX-UHFFFAOYSA-N
TotalMolweight410.181
Molweight410.181
MonoisotopicMass409.992754
CLogP2.4847
CLogS-5.01
H Acceptors4
H Donors2
TotalSurfaceArea250.57
Relative PSA0.19555
PolarSurfaceArea58.2
Druglikeness-0.17941
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68182
Fragments1
Non HAtoms22
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Symmetricatoms2
StereoCon

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