5-bromo-N-[(Z)-[(2Z)-2-[(5-bromo-2-hydroxybenzoyl)hydrazinylidene]ethylidene]amino]-2-hydroxybenzamide

Formula:C16H12N4O4Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:low 5-bromo-N-[(Z)-[(2Z)-2-[(5-bromo-2-hydroxybenzoyl)hydrazinylidene]ethylidene]amino]-2-hydroxybenzamide is a drug-like molecule.

MolName5-bromo-N-[(Z)-[(2Z)-2-[(5-bromo-2-hydroxybenzoyl)hydrazinylidene]ethylidene]amino]-2-hydroxybenzamide
MolecularFormulaC16H12N4O4Br2
SmilesOc(ccc(Br)c1)c1C(N/N=C\C=N/NC(c(cc(cc1)Br)c1O)=O)=O
InChIInChI=1S/C16H12Br2N4O4/c17-9-1-3-13(23)11(7-9)15(25)21-19-5-6-20-22-16(26)12-8-10(18)2-4-14(12)24/h1-8,23-24H,(H,21,25)(H,22,26)
InChIKUPPGJEJITYOIMU-UHFFFAOYSA-N
TotalMolweight484.103
Molweight484.103
MonoisotopicMass481.922528
CLogP2.6756
CLogS-5.038
H Acceptors8
H Donors4
TotalSurfaceArea290.92
Relative PSA0.33762
PolarSurfaceArea123.38
Druglikeness2.6304
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.61538
Fragments1
Non HAtoms26
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms13
StereoCon

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