In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 30 | No |
Popular Name: CCRIS 3604; EINECS 259-242-2; LS-87930; Leupeptin; Leupeptins; Peptides, leupeptins CCRIS 3604; EINECS 259-242-2; LS…
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.16 | 4.99 | -51.28 | 8 | 10 | 1 | 168 | 427.57 | 15 | ↓ |
Mid Mid (pH 6-8) | 0.03 | 5.3 | -57.32 | 8 | 10 | 1 | 170 | 427.57 | 14 | ↓ |
Lo Low (pH 4.5-6) | 0.16 | 5.61 | -96.89 | 9 | 10 | 2 | 173 | 428.578 | 15 | ↓ |
Lo Low (pH 4.5-6) | 0.03 | 5.42 | -99.25 | 9 | 10 | 2 | 175 | 428.578 | 14 | ↓ |
No pre-computed analogs available. Try a structural similarity search.