(5Z)-2,4-bis(4-bromoanilino)-5-[(4-bromophenyl)methylidene]cyclopent-2-en-1-one

Formula:C24H17N2OBr3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-2,4-bis(4-bromoanilino)-5-[(4-bromophenyl)methylidene]cyclopent-2-en-1-one is not a drug-like molecule.

MolName	(5Z)-2,4-bis(4-bromoanilino)-5-[(4-bromophenyl)methylidene]cyclopent-2-en-1-one
MolecularFormula	C24H17N2OBr3
Smiles	O=C(/C1=C\c(cc2)ccc2Br)C(Nc(cc2)ccc2Br)=CC1Nc(cc1)ccc1Br
InChI	InChI=1S/C24H17Br3N2O/c25-16-3-1-15(2-4-16)13-21-22(28-19-9-5-17(26)6-10-19)14-23(24(21)30)29-20-11-7-18(27)8-12-20/h1-14,22,28-29H/t22-/m1/s1
InChIK	WTBOBXYJEJJTSU-JOCHJYFZSA-N
TotalMolweight	589.124
Molweight	589.124
MonoisotopicMass	585.889096
CLogP	6.6219
CLogS	-7.73
H Acceptors	3
H Donors	2
TotalSurfaceArea	337.76
Relative PSA	0.10647
PolarSurfaceArea	41.13
Druglikeness	0.15087
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	6
Amines	1
Aromatic Amines	1
StereoCon	racemate

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