ro5_violations
Count of Lipinski Ro5 violations (MW≤500, cLogP≤5, HBD≤5, HBA≤10). bRo5 oral-space classification (Doak 2014) carried in payload. Developability framing for macrocyclic peptides.
Calculated from chemical structure (RDKit) when a peptide-scale SMILES is available (MW ≤ 10 kDa). Values appear on peptide records under the physicochemical profile.
Peptides with the highest values for this descriptor (of 14,327 computed). Each links to its peptide page.
| Peptide | Sequence | Value |
|---|---|---|
| ATLPC0006608 | ['dA', 'meF', 'L', 'Mono51', 'T' | beyond bro5 |
| ATLPC0003744 |
| ['dV', 'meL', 'meF', 'meL', 'H', |
| beyond bro5 |
| ATLPC0020782 | ['dV', 'T', 'meF', 'I', 'meA', ' | beyond bro5 |
| ATLPC0009723 | ['Mono6', 'meL', 'I', 'meF', 'Me | beyond bro5 |
| ATLPC0015814 | KLLKLLLKLLKLLLKLLLKLLK | beyond bro5 |
| ATLPC0006051 | KLLKLLLKLLKLLLKLLLKLLK | beyond bro5 |
| ATLPC0018953 | KLLKLLLKLLKLLLKLLLKLLK | beyond bro5 |
| ATLPC0019590 | ['L', 'V', 'meL', 'F', 'meF', 'I | beyond bro5 |
| ATLPC0009523 | ['V', 'Sar', 'L', 'meL', 'A', 'm | beyond bro5 |
| ATLPC0005012 | ILPWKWPWWPWR | beyond bro5 |
| ATLPC0012858 | ILPWKWPWWPWR | beyond bro5 |
| ATLPC0002066 | ['dL', 'meL', 'meF', 'meF', 'Ser | beyond bro5 |