arry-502 Report issue

Small molecule Experimental
AACT ChEMBL PubChem

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Chemistry

Mol. Mass

516.38

ALogP

5.72

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COc1cc(Cl)ccc1CCNC(=O)c1ccc(Oc2cc3c(cc2Cl)[C@@H](C(=O)O)CCO3)cc1
  • InChIKey: QIDYUNXQPQEJEC-IBGZPJMESA-N
    InChI=1S/C26H23Cl2NO6/c1-33-22-12-17(27)5-2-15(22)8-10-29-25(30)16-3-6-18(7-4-16)35-24-14-23-20(13-21(24)28)19(26(31)32)9-11-34-23/h2-7,12-14,19H,8-11H2,1H3,(H,29,30)(H,31,32)/t19-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545109   ChEMBL
arry-502

CHEMBL5314403   ChEMBL
arry-502

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