Structure of molecule 2268

Molecule card · MolClass #2268

OLMESARTAN MEDOXOMIL

OLMESARTAN MEDOXOMIL: 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
OLMESARTAN MEDOXOMILCompound accumulation in C. elegans · compound_name
MolClass ID
2268
InChIKey
Not recorded
Canonical SMILES
CCCc5nc(c(C(=O)OCC=1OC(=O)OC=1(C))n5(Cc2ccc(cc2)c4ccccc4(c3n[nH]nn3)))C(C)(C)O
Standard InChI
null
Stored Murcko scaffold
n1nc(n[nH]1)-c2ccccc2-c3ccc(cc3)Cn4cncc4[CH]OCC=5O[CH]OC5

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.

No other molecules currently have this stored scaffold.

Calculated molecular properties

Stored descriptor calculations, not measured experimental values.

Hydrogen bond acceptors
10
CDK 2.12 · 2026-08-19
Hydrogen bond donors
2
CDK 2.12 · 2026-08-19
Rotatable bonds
11
CDK 2.12 · 2026-08-19
Topological polar surface area
154.34 Ų
CDK 2.12 · 2026-08-19
Molecular weight
558.586 g/mol
CDK 2.12 · 2026-08-19
XLogP
5.935
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.

No saved predictions yet. Explore classification models to choose a prediction.

Source datasets

Dataset registrations and identifiers stored in MolClass.

  • Compound accumulation in C. elegans

    Dataset #4 · -10.4054756077199