N-[(Z)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]-3-iodobenzamide

Formula:C24H18N4O2FI Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]-3-iodobenzamide is not a drug-like molecule.

MolName	N-[(Z)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]-3-iodobenzamide
MolecularFormula	C24H18N4O2FI
Smiles	O=C(Cn1c(cccc2)c2c(/C=N\NC(c2cccc(I)c2)=O)c1)Nc(cc1)ccc1F
InChI	InChI=1S/C24H18FIN4O2/c25-18-8-10-20(11-9-18)28-23(31)15-30-14-17(21-6-1-2-7-22(21)30)13-27-29-24(32)16-4-3-5-19(26)12-16/h1-14H,15H2,(H,28,31)(H,29,32)
InChIK	HRKVZMZFLIKCSD-UHFFFAOYSA-N
TotalMolweight	540.331
Molweight	540.331
MonoisotopicMass	540.045852
CLogP	4.5538
CLogS	-6.218
H Acceptors	6
H Donors	2
TotalSurfaceArea	346.15
Relative PSA	0.19466
PolarSurfaceArea	75.49
Druglikeness	5.7932
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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1 - N-[(Z)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]-3-iodobenzamide | 2 - N-[(Z)-[1-[2-(4-fluoroanilino)-2-oxoethyl]indol-3-yl]methylideneamino]-3-iodobenzamide

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