(3Z)-3-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]-1H-indol-2-one

Formula:C18H12N3OF Mutagenic:none Tumorigenic:none Reproductive Effective:none (3Z)-3-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]-1H-indol-2-one is a drug-like molecule.

MolName(3Z)-3-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene]-1H-indol-2-one
MolecularFormulaC18H12N3OF
SmilesO=C1Nc(cccc2)c2/C1=C/c1c(-c(cc2)ccc2F)[nH]nc1
InChIInChI=1S/C18H12FN3O/c19-13-7-5-11(6-8-13)17-12(10-20-22-17)9-15-14-3-1-2-4-16(14)21-18(15)23/h1-10H,(H,20,22)(H,21,23)
InChIKIDWQKVGKWZLJDV-UHFFFAOYSA-N
TotalMolweight305.311
Molweight305.311
MonoisotopicMass305.09644
CLogP2.0103
CLogS-4.034
H Acceptors4
H Donors2
TotalSurfaceArea227.88
Relative PSA0.21704
PolarSurfaceArea57.78
Druglikeness3.6511
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.56522
Fragments1
Non HAtoms23
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond2
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Symmetricatoms2
Amides1
Aromatic Nitrogens2
StereoCon

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