(Z,E)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-(furan-2-yl)prop-2-en-1-imine

Formula:C24H24N3O Mutagenic:high Tumorigenic:high Reproductive Effective:none (Z,E)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-(furan-2-yl)prop-2-en-1-imine is a drug-like molecule.

MolName(Z,E)-N-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-(furan-2-yl)prop-2-en-1-imine
MolecularFormulaC24H24N3O
SmilesC(C[NH+](CC1)C2c(cccc3)c3-c3c2cccc3)N1/N=C\C=C\c1ccco1
InChIInChI=1S/C24H23N3O/c1-3-11-22-20(9-1)21-10-2-4-12-23(21)24(22)26-14-16-27(17-15-26)25-13-5-7-19-8-6-18-28-19/h1-13,18,24H,14-17H2/p+1
InChIKJAZXDODTSZKGSQ-UHFFFAOYSA-O
TotalMolweight370.475
Molweight370.475
MonoisotopicMass370.191937
CLogP2.0061
CLogS-4.89
H Acceptors4
H Donors1
TotalSurfaceArea308.91
Relative PSA0.15137
PolarSurfaceArea33.18
Druglikeness3.6185
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.57143
Fragments1
Non HAtoms28
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond4
Rings Closures5
Small Rings5
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms7
Symmetricatoms8
Amines1
AlkylAmines1
BasicNitrogens1
StereoCon

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