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

Formula:C18H15N4O3I Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[1-(2-amino-2-oxoethyl)indol-3-yl]methylideneamino]-3-hydroxy-4-iodobenzamide is a drug-like molecule.

MolName	N-[(Z)-[1-(2-amino-2-oxoethyl)indol-3-yl]methylideneamino]-3-hydroxy-4-iodobenzamide
MolecularFormula	C18H15N4O3I
Smiles	NC(Cn1c(cccc2)c2c(/C=N\NC(c(cc2)cc(O)c2I)=O)c1)=O
InChI	InChI=1S/C18H15IN4O3/c19-14-6-5-11(7-16(14)24)18(26)22-21-8-12-9-23(10-17(20)25)15-4-2-1-3-13(12)15/h1-9,24H,10H2,(H2,20,25)(H,22,26)
InChIK	XAULKIDBTCCRDE-UHFFFAOYSA-N
TotalMolweight	462.242
Molweight	462.242
MonoisotopicMass	462.018889
CLogP	2.0471
CLogS	-4.185
H Acceptors	7
H Donors	3
TotalSurfaceArea	283.45
Relative PSA	0.29737
PolarSurfaceArea	109.71
Druglikeness	7.4155
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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