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

Formula:C31H23N3O4 Mutagenic:low Tumorigenic:high Reproductive Effective:none [4-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] naphthalene-1-carboxylate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] naphthalene-1-carboxylate
MolecularFormula	C31H23N3O4
Smiles	O=C(CNC(c1cccc2ccccc12)=O)N/N=C\c(cc1)ccc1OC(c1cccc2ccccc12)=O
InChI	InChI=1S/C31H23N3O4/c35-29(20-32-30(36)27-13-5-9-22-7-1-3-11-25(22)27)34-33-19-21-15-17-24(18-16-21)38-31(37)28-14-6-10-23-8-2-4-12-26(23)28/h1-19H,20H2,(H,32,36)(H,34,35)
InChIK	MXBRRNMDJANONX-UHFFFAOYSA-N
TotalMolweight	501.541
Molweight	501.541
MonoisotopicMass	501.168857
CLogP	6.1046
CLogS	-8.17
H Acceptors	7
H Donors	2
TotalSurfaceArea	386.67
Relative PSA	0.21608
PolarSurfaceArea	96.86
Druglikeness	5.0531
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.60526
Fragments	1
Non HAtoms	38
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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