4-cyano-N-[(Z)-[3,5-dichloro-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2-fluorobenzamide

Formula:C26H16N3O2Cl2F Mutagenic:low Tumorigenic:high Reproductive Effective:none 4-cyano-N-[(Z)-[3,5-dichloro-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2-fluorobenzamide is not a drug-like molecule.

MolName	4-cyano-N-[(Z)-[3,5-dichloro-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2-fluorobenzamide
MolecularFormula	C26H16N3O2Cl2F
Smiles	N#Cc(cc1)cc(F)c1C(N/N=C\c(cc1Cl)cc(Cl)c1OCc1cccc2ccccc12)=O
InChI	InChI=1S/C26H16Cl2FN3O2/c27-22-10-17(14-31-32-26(33)21-9-8-16(13-30)12-24(21)29)11-23(28)25(22)34-15-19-6-3-5-18-4-1-2-7-20(18)19/h1-12,14H,15H2,(H,32,33)
InChIK	RJPSOKGBLAUUSQ-UHFFFAOYSA-N
TotalMolweight	492.336
Molweight	492.336
MonoisotopicMass	491.060359
CLogP	6.8925
CLogS	-9.227
H Acceptors	5
H Donors	1
TotalSurfaceArea	364.01
Relative PSA	0.16365
PolarSurfaceArea	74.48
Druglikeness	-1.5686
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	3
StereoCon

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