(Z)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenylmethanimine
Molecular Formula : C24H24N3 | Mutagenic : high | Tumorigenic : high | Reproductive Effective : none |(Z)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenylmethanimine is a drug-like molecule.
MolName : (Z)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-1-phenylmethanimine |
MolecularFormula : C24H24N3 |
Smiles : C(C[NH+](CC1)C2c(cccc3)c3-c3c2cccc3)N1/N=C\c1ccccc1 |
InChI : InChI=1S/C24H23N3/c1-2-8-19(9-3-1)18-25-27-16-14-26(15-17-27)24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h1-13,18,24H,14-17H2/p+1 |
InChIK : JGAYKEAZJXUZJD-UHFFFAOYSA-O |
TotalMolweight : 354.476 |
Molweight : 354.476 |
MonoisotopicMass : 354.197022 |
CLogP : 2.7991 |
CLogS : -4.916 |
H Acceptors : 3 |
H Donors : 1 |
TotalSurfaceArea : 292.72 |
Relative PSA : 0.11154 |
PolarSurfaceArea : 20.04 |
Druglikeness : 4.0084 |
Mutagenic : high |
Tumorigenic : high |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : imine/hydrazone of aldehyde |
Shape Index : 0.55556 |
Fragments : 1 |
Non HAtoms : 27 |
NonCHAtoms : 3 |
Electronegative Atoms : 3 |
Rotatable Bond : 3 |
Rings Closures : 5 |
Small Rings : 5 |
Aromatic Rings : 3 |
Aromatic Atoms : 18 |
Sp3Atoms : 7 |
Symmetricatoms : 10 |
Amines : 1 |
AlkylAmines : 1 |
BasicNitrogens : 1 |
StereoCon : |