N-(4-fluorophenyl)-7-hydroxy-2-oxochromene-3-carboxamide

Formula:C16H10NO4F Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(4-fluorophenyl)-7-hydroxy-2-oxochromene-3-carboxamide is a drug-like molecule.

MolNameN-(4-fluorophenyl)-7-hydroxy-2-oxochromene-3-carboxamide
MolecularFormulaC16H10NO4F
SmilesOc(cc1)cc(O2)c1C=C(C(Nc(cc1)ccc1F)=O)C2=O
InChIInChI=1S/C16H10FNO4/c17-10-2-4-11(5-3-10)18-15(20)13-7-9-1-6-12(19)8-14(9)22-16(13)21/h1-8,19H,(H,18,20)
InChIKPVZAOUZICKJXBV-UHFFFAOYSA-N
TotalMolweight299.256
Molweight299.256
MonoisotopicMass299.059387
CLogP2.0788
CLogS-3.486
H Acceptors5
H Donors2
TotalSurfaceArea213.89
Relative PSA0.28351
PolarSurfaceArea75.63
Druglikeness-1.2366
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionstwice activated DB
Shape Index0.63636
Fragments1
Non HAtoms22
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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