(NZ)-N-[3-(4-chloroanilino)-4-oxonaphthalen-1-ylidene]naphthalene-2-sulfonamide

Formula:C26H17N2O3ClS Mutagenic:high Tumorigenic:none Reproductive Effective:none (NZ)-N-[3-(4-chloroanilino)-4-oxonaphthalen-1-ylidene]naphthalene-2-sulfonamide is not a drug-like molecule.

MolName(NZ)-N-[3-(4-chloroanilino)-4-oxonaphthalen-1-ylidene]naphthalene-2-sulfonamide
MolecularFormulaC26H17N2O3ClS
SmilesO=C(c1c2cccc1)C(Nc(cc1)ccc1Cl)=C/C2=N/S(c1cc2ccccc2cc1)(=O)=O
InChIInChI=1S/C26H17ClN2O3S/c27-19-10-12-20(13-11-19)28-25-16-24(22-7-3-4-8-23(22)26(25)30)29-33(31,32)21-14-9-17-5-1-2-6-18(17)15-21/h1-16,28H
InChIKAIBMCWTWRJJHBP-UHFFFAOYSA-N
TotalMolweight472.951
Molweight472.951
MonoisotopicMass472.06484
CLogP5.605
CLogS-7.706
H Acceptors5
H Donors1
TotalSurfaceArea334.77
Relative PSA0.19294
PolarSurfaceArea83.98
Druglikeness0.41792
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.51515
Fragments1
Non HAtoms33
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms1
Symmetricatoms3
BasicNitrogens1
StereoCon

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