ulimorelin Report issue

Small molecule Experimental
AACT ChEMBL DrugBank MeSH PubChem

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Chemistry

Mol. Mass

538.66

ALogP

2.6

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@@H]1CN[C@@H](C2CC2)C(=O)N(C)[C@H](C)C(=O)N[C@H](Cc3ccc(F)cc3)C(=O)NCCCc4ccccc4O1
  • InChIKey: WGYPAJVJMXQXTR-ABNZCKJZSA-N
    InChI=1S/C30H39FN4O4/c1-19-18-33-27(23-12-13-23)30(38)35(3)20(2)28(36)34-25(17-21-10-14-24(31)15-11-21)29(37)32-16-6-8-22-7-4-5-9-26(22)39-19/h4-5,7,9-11,14-15,19-20,23,25,27,33H,6,8,12-13,16-18H2,1-3H3,(H,32,37)(H,34,36)/t19-,20-,25-,27+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1963249   ChEMBL
ulimorelin *

CHEMBL1923502   ChEMBL
ulimorelin hydrochloride

K2X1EE8C73   NCATS
tz-101 *

Ulimorelin   Wikipedia

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