omadacycline (nuzyra) Report issue

Small molecule Approved FDA Fast Track FDA Priority Review FDA

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Chemistry

Mol. Mass

556.66

ALogP

1.32

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(CNCC(C)(C)C)c(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)N(C)C
  • InChIKey: JEECQCWWSTZDCK-IQZGDKDPSA-N
    InChI=1S/C29H40N4O7/c1-28(2,3)12-31-11-14-10-17(32(4)5)15-8-13-9-16-21(33(6)7)24(36)20(27(30)39)26(38)29(16,40)25(37)18(13)23(35)19(15)22(14)34/h10,13,16,21,31,34,36-37,40H,8-9,11-12H2,1-7H3,(H2,30,39)/t13-,16-,21-,29-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1689772   ChEMBL
omadacycline *

CHEMBL2103854   ChEMBL
omadacycline tosylate

090IP5RV8F   NCATS
omadacycline *

Omadacycline   Wikipedia

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