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MolName : N-[(Z)-[1-(2-morpholin-4-yl-2-oxoethyl)indol-3-yl]methylideneamino]naphthalene-2-carboxamide

MolecularFormula : C26H24N4O3

Smiles : O=C(Cn1c(cccc2)c2c(/C=N\NC(c2cc3ccccc3cc2)=O)c1)N1CCOCC1

InChI : InChI=1S/C26H24N4O3/c31-25(29-11-13-33-14-12-29)18-30-17-22(23-7-3-4-8-24(23)30)16-27-28-26(32)21-10-9-19-5-1-2-6-20(19)15-21/h1-10,15-17H,11-14,18H2,(H,28,32)

InChIK : TYDDTOOXDVMWRX-UHFFFAOYSA-N

TotalMolweight : 440.502

Molweight : 440.502

MonoisotopicMass : 440.184841

CLogP : 3.7371

CLogS : -4.692

H Acceptors : 7

H Donors : 1

TotalSurfaceArea : 338.74

Relative PSA : 0.20508

PolarSurfaceArea : 75.93

Druglikeness : 6.247

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde

Shape Index : 0.57576

Fragments : 1

Non HAtoms : 33

NonCHAtoms : 7

Electronegative Atoms : 7

Rotatable Bond : 5

Rings Closures : 5

Small Rings : 5

Aromatic Rings : 4

Aromatic Atoms : 19

Sp3Atoms : 6

Symmetricatoms : 2

Amides : 1

Aromatic Nitrogens : 1

StereoCon :