N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide

Formula:C17H18N6O2 Mutagenic:low Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide is a drug-like molecule.

MolNameN,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide
MolecularFormulaC17H18N6O2
SmilesO=C(CCCC(N/N=C\c1ncccc1)=O)N/N=C\c1ncccc1
InChIInChI=1S/C17H18N6O2/c24-16(22-20-12-14-6-1-3-10-18-14)8-5-9-17(25)23-21-13-15-7-2-4-11-19-15/h1-4,6-7,10-13H,5,8-9H2,(H,22,24)(H,23,25)
InChIKFLWQNBAFWTXYIC-UHFFFAOYSA-N
TotalMolweight338.37
Molweight338.37
MonoisotopicMass338.149124
CLogP2.0078
CLogS-3.386
H Acceptors8
H Donors2
TotalSurfaceArea279.76
Relative PSA0.33586
PolarSurfaceArea108.7
Druglikeness-1.2495
Mutageniclow
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.76
Fragments1
Non HAtoms25
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms12
Aromatic Nitrogens2
StereoCon

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