Molecule card · MolClass #1811

Methazolamide

Methazolamide: molecular structure, identifiers, source datasets and 0 saved model results in MolClass.

1 source records · 0 model builds with saved results

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Structure and identifiers

Imported compound names: MethazolamideFlucanozole Synergizer · compound_name
MolClass ID: 1811
InChIKey: FLOSMHQXBMRNHR-DAXSKMNVSA-N
Canonical SMILES: CC(=O)N=C1N(C)N=C(S1)S(N)(=O)=O
Standard InChI: InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)/b7-4-
Stored Murcko scaffold: N1=CS[CH]N1

Registry normalization: MIGRATED_RAW. A registry entry does not establish drug approval or clinical use.

Molecules with the same Murcko scaffold

Exact matches to the stored ring-and-linker framework. Sharing a scaffold does not by itself establish activity or applicability to a model.

56422398#31708
CN1N=C(SC1=NC(C)=O)S(N)(=O)=O#155019

Calculated molecular properties

Stored descriptor calculations, not measured experimental values.

Hydrogen bond acceptors: 7; CDK 2.12 · 2026-08-19
Hydrogen bond donors: 1; CDK 2.12 · 2026-08-19
Rotatable bonds: 2; CDK 2.12 · 2026-08-19
Topological polar surface area: 138.87 Å²; CDK 2.12 · 2026-08-19
Molecular weight: 236.274 g/mol; CDK 2.12 · 2026-08-19
XLogP: -0.982; CDK 2.12 · 2026-08-19

Saved model predictions

Computational predictions, not experimental measurements or clinical guidance. Results depend on the model build; applicability indicates similarity to its training chemistry.

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Source datasets

Dataset registrations and identifiers stored in MolClass.

Flucanozole Synergizer
Dataset #3 · Methazolamide