treprostinil (remodulin) Report issue

Small molecule Orphan Drug FDA Approved FDA Accelerated Approval FDA Priority Review FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

390.52

ALogP

3.58

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCCCC[C@H](O)CC[C@H]1[C@H](O)C[C@@H]2Cc3c(C[C@H]12)cccc3OCC(=O)O
  • InChIKey: PAJMKGZZBBTTOY-ZFORQUDYSA-N
    InChI=1S/C23H34O5/c1-2-3-4-7-17(24)9-10-18-19-11-15-6-5-8-22(28-14-23(26)27)20(15)12-16(19)13-21(18)25/h5-6,8,16-19,21,24-25H,2-4,7,9-14H2,1H3,(H,26,27)/t16-,17-,18+,19-,21+/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1237119   ChEMBL
treprostinil *

CHEMBL2107815   ChEMBL
treprostinil diolamine

RUM6K67ESG   NCATS
treprostinil *

Treprostinil   Wikipedia

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