N-[(Z)-naphthalen-2-ylmethylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine
Molecular Formula : C15H16N4 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |N-[(Z)-naphthalen-2-ylmethylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine is a drug-like molecule.
MolName : N-[(Z)-naphthalen-2-ylmethylideneamino]-1,4,5,6-tetrahydropyrimidin-2-amine |
MolecularFormula : C15H16N4 |
Smiles : C1CN=C(N/N=C\c2cc3ccccc3cc2)NC1 |
InChI : InChI=1S/C15H16N4/c1-2-5-14-10-12(6-7-13(14)4-1)11-18-19-15-16-8-3-9-17-15/h1-2,4-7,10-11H,3,8-9H2,(H2,16,17,19) |
InChIK : PHLIIHPZJPKVJI-UHFFFAOYSA-N |
TotalMolweight : 252.32 |
Molweight : 252.32 |
MonoisotopicMass : 252.137496 |
CLogP : 2.9502 |
CLogS : -4.808 |
H Acceptors : 4 |
H Donors : 2 |
TotalSurfaceArea : 206.29 |
Relative PSA : 0.2227 |
PolarSurfaceArea : 48.78 |
Druglikeness : 4.367 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : imine/hydrazone of aldehyde |
Shape Index : 0.68421 |
Fragments : 1 |
Non HAtoms : 19 |
NonCHAtoms : 4 |
Electronegative Atoms : 4 |
Rotatable Bond : 2 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 10 |
Sp3Atoms : 3 |
BasicNitrogens : 1 |
StereoCon : |