[4-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C27H19N3O4Cl2 Mutagenic:none Tumorigenic:high Reproductive Effective:none [4-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormula	C27H19N3O4Cl2
Smiles	O=C(CNC(c1cccc2ccccc12)=O)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C27H19Cl2N3O4/c28-19-10-13-23(24(29)14-19)27(35)36-20-11-8-17(9-12-20)15-31-32-25(33)16-30-26(34)22-7-3-5-18-4-1-2-6-21(18)22/h1-15H,16H2,(H,30,34)(H,32,33)
InChIK	NARCFXBILUVZDR-UHFFFAOYSA-N
TotalMolweight	520.371
Molweight	520.371
MonoisotopicMass	519.075261
CLogP	6.1222
CLogS	-8.036
H Acceptors	7
H Donors	2
TotalSurfaceArea	382.91
Relative PSA	0.2182
PolarSurfaceArea	96.86
Druglikeness	5.1016
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.63889
Fragments	1
Non HAtoms	36
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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