tas-119 Report issue

Small molecule Experimental
AACT ChEMBL

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Chemistry

Mol. Mass

506.37

ALogP

4.85

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cc1cc(Nc2nc(CC3(C(=O)O)CCN(C(=O)c4cccc(Cl)c4Cl)CC3)ccc2F)n[nH]1
  • InChIKey: PLAVWQHGBMTMFR-UHFFFAOYSA-N
    InChI=1S/C23H22Cl2FN5O3/c1-13-11-18(30-29-13)28-20-17(26)6-5-14(27-20)12-23(22(33)34)7-9-31(10-8-23)21(32)15-3-2-4-16(24)19(15)25/h2-6,11H,7-10,12H2,1H3,(H,33,34)(H2,27,28,29,30)
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545326   ChEMBL
tas-119

CHEMBL3692206   ChEMBL
tas-119

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