molibresib Report issue

Small molecule Experimental
AACT MeSH PubChem

Back

Chemistry

Mol. Mass

423.9

ALogP

3.66

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc21
  • InChIKey: AAAQFGUYHFJNHI-SFHVURJKSA-N
    InChI=1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1232461   ChEMBL
molibresib

CHEMBL4297217   ChEMBL
molibresib besylate

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue