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(NZ)-N-[2-[6,7-dichloro-3-[(2E)-2-hydroxyimino-2-naphthalen-1-ylethyl]quinoxalin-2-yl]-1-naphthalen-1-ylethylidene]hydroxylamine

Formula:C32H22N4O2Cl2 Mutagenic:low Tumorigenic:high Reproductive Effective:none (NZ)-N-[2-[6,7-dichloro-3-[(2E)-2-hydroxyimino-2-naphthalen-1-ylethyl]quinoxalin-2-yl]-1-naphthalen-1-ylethylidene]hydroxylamine is not a drug-like molecule.
MolName(NZ)-N-[2-[6,7-dichloro-3-[(2E)-2-hydroxyimino-2-naphthalen-1-ylethyl]quinoxalin-2-yl]-1-naphthalen-1-ylethylidene]hydroxylamine
MolecularFormulaC32H22N4O2Cl2
SmilesO/N=C(\Cc1c(C/C(/c2cccc3ccccc23)=N/O)nc(cc(c(Cl)c2)Cl)c2n1)/c1cccc2ccccc12
InChIInChI=1S/C32H22Cl2N4O2/c33-25-15-29-30(16-26(25)34)36-32(18-28(38-40)24-14-6-10-20-8-2-4-12-22(20)24)31(35-29)17-27(37-39)23-13-5-9-19-7-1-3-11-21(19)23/h1-16,39-40H,17-18H2
InChIKXGAXJFRCSPWSHO-UHFFFAOYSA-N
TotalMolweight565.459
Molweight565.459
MonoisotopicMass564.11198
CLogP8.675
CLogS-10.542
H Acceptors6
H Donors2
TotalSurfaceArea411.1
Relative PSA0.1731
PolarSurfaceArea90.96
Druglikeness-1.0312
Mutageniclow
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.4
Fragments1
Non HAtoms40
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures6
Small Rings6
Aromatic Rings6
Aromatic Atoms30
Sp3Atoms4
Aromatic Nitrogens2
StereoCon

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