3,5-dibromo-N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-hydroxybenzamide

Formula:C30H20N3O2Br3 Mutagenic:none Tumorigenic:none Reproductive Effective:high 3,5-dibromo-N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-hydroxybenzamide is not a drug-like molecule.

MolName	3,5-dibromo-N-[(Z)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-2-hydroxybenzamide
MolecularFormula	C30H20N3O2Br3
Smiles	Oc(c(C(N/N=C\c(cc1-c2ccccc2)c(-c2ccccc2)n1-c(cc1)ccc1Br)=O)cc(Br)c1)c1Br
InChI	InChI=1S/C30H20Br3N3O2/c31-22-11-13-24(14-12-22)36-27(19-7-3-1-4-8-19)15-21(28(36)20-9-5-2-6-10-20)18-34-35-30(38)25-16-23(32)17-26(33)29(25)37/h1-18,37H,(H,35,38)
InChIK	ZWUWISYQELMCGU-UHFFFAOYSA-N
TotalMolweight	694.22
Molweight	694.22
MonoisotopicMass	690.91056
CLogP	8.7168
CLogS	-11.796
H Acceptors	5
H Donors	2
TotalSurfaceArea	417.71
Relative PSA	0.13402
PolarSurfaceArea	66.62
Druglikeness	3.767
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.42105
Fragments	1
Non HAtoms	38
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	29
Sp3Atoms	1
Symmetricatoms	6
Aromatic Nitrogens	1
StereoCon

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