4-bromo-N-[(Z)-(2,3,5,6-tetraphenylinden-1-ylidene)amino]aniline

Formula:C39H27N2Br Mutagenic:none Tumorigenic:none Reproductive Effective:high 4-bromo-N-[(Z)-(2,3,5,6-tetraphenylinden-1-ylidene)amino]aniline is not a drug-like molecule.

MolName	4-bromo-N-[(Z)-(2,3,5,6-tetraphenylinden-1-ylidene)amino]aniline
MolecularFormula	C39H27N2Br
Smiles	Brc(cc1)ccc1N/N=C(/c1c2cc(-c3ccccc3)c(-c3ccccc3)c1)\C(c1ccccc1)=C2c1ccccc1
InChI	InChI=1S/C39H27BrN2/c40-31-21-23-32(24-22-31)41-42-39-36-26-34(28-15-7-2-8-16-28)33(27-13-5-1-6-14-27)25-35(36)37(29-17-9-3-10-18-29)38(39)30-19-11-4-12-20-30/h1-26,41H
InChIK	YOARUBKUMNFGNR-UHFFFAOYSA-N
TotalMolweight	603.561
Molweight	603.561
MonoisotopicMass	602.135759
CLogP	11.805
CLogS	-11.131
H Acceptors	2
H Donors	1
TotalSurfaceArea	434.54
Relative PSA	0.05286
PolarSurfaceArea	24.39
Druglikeness	-0.052226
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.38095
Fragments	1
Non HAtoms	42
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	6
Rings Closures	7
Small Rings	7
Aromatic Rings	6
Aromatic Atoms	36
Symmetricatoms	10
StereoCon

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