2-[(Z)-[(2E)-1,5,5-tris(4-chlorophenyl)penta-2,4-dienylidene]amino]guanidine

Formula:C24H19N4Cl3 Mutagenic:none Tumorigenic:high Reproductive Effective:high 2-[(Z)-[(2E)-1,5,5-tris(4-chlorophenyl)penta-2,4-dienylidene]amino]guanidine is not a drug-like molecule.

MolName2-[(Z)-[(2E)-1,5,5-tris(4-chlorophenyl)penta-2,4-dienylidene]amino]guanidine
MolecularFormulaC24H19N4Cl3
SmilesNC(N)=N/N=C(/C=C/C=C(c(cc1)ccc1Cl)c(cc1)ccc1Cl)\c(cc1)ccc1Cl
InChIInChI=1S/C24H19Cl3N4/c25-19-10-4-16(5-11-19)22(17-6-12-20(26)13-7-17)2-1-3-23(30-31-24(28)29)18-8-14-21(27)15-9-18/h1-15H,(H4,28,29,31)
InChIKCGERTGROJICAEY-UHFFFAOYSA-N
TotalMolweight469.802
Molweight469.802
MonoisotopicMass468.067527
CLogP6.6075
CLogS-8.615
H Acceptors4
H Donors2
TotalSurfaceArea353.23
Relative PSA0.15163
PolarSurfaceArea76.76
Druglikeness1.1894
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functionsdimethylene-hydrazine
Shape Index0.48387
Fragments1
Non HAtoms31
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Symmetricatoms12
BasicNitrogens1
StereoCon

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