N-[(Z)-furan-2-ylmethylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine

Formula:C19H26N6O Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-furan-2-ylmethylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine is not a drug-like molecule.

MolNameN-[(Z)-furan-2-ylmethylideneamino]-2,6-di(piperidin-1-yl)pyrimidin-4-amine
MolecularFormulaC19H26N6O
SmilesC(CC1)CCN1c1cc(N/N=C\c2ccco2)nc(N2CCCCC2)n1
InChIInChI=1S/C19H26N6O/c1-3-9-24(10-4-1)18-14-17(23-20-15-16-8-7-13-26-16)21-19(22-18)25-11-5-2-6-12-25/h7-8,13-15H,1-6,9-12H2,(H,21,22,23)
InChIKMEHOTBYPNNGRLG-UHFFFAOYSA-N
TotalMolweight354.456
Molweight354.456
MonoisotopicMass354.216809
CLogP5.2047
CLogS-5.132
H Acceptors7
H Donors1
TotalSurfaceArea287.65
Relative PSA0.22986
PolarSurfaceArea69.79
Druglikeness2.2189
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.5
Fragments1
Non HAtoms26
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms10
Symmetricatoms4
Aromatic Nitrogens2
BasicNitrogens2
StereoCon

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