N-[(Z)-[4,4,4-trifluoro-1-(4-fluorophenyl)-3-oxobutylidene]amino]pyridine-4-carboxamide

Formula:C16H11N3O2F4 Mutagenic:none Tumorigenic:high Reproductive Effective:high N-[(Z)-[4,4,4-trifluoro-1-(4-fluorophenyl)-3-oxobutylidene]amino]pyridine-4-carboxamide is a drug-like molecule.

MolName	N-[(Z)-[4,4,4-trifluoro-1-(4-fluorophenyl)-3-oxobutylidene]amino]pyridine-4-carboxamide
MolecularFormula	C16H11N3O2F4
Smiles	O=C(C/C(/c(cc1)ccc1F)=N/NC(c1ccncc1)=O)C(F)(F)F
InChI	InChI=1S/C16H11F4N3O2/c17-12-3-1-10(2-4-12)13(9-14(24)16(18,19)20)22-23-15(25)11-5-7-21-8-6-11/h1-8H,9H2,(H,23,25)
InChIK	IMJZNGVWBABKTC-UHFFFAOYSA-N
TotalMolweight	353.274
Molweight	353.274
MonoisotopicMass	353.078739
CLogP	2.5795
CLogS	-4.532
H Acceptors	5
H Donors	1
TotalSurfaceArea	251.28
Relative PSA	0.23886
PolarSurfaceArea	71.42
Druglikeness	-29.73
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	6
Aromatic Nitrogens	1
StereoCon

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