In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 21 | Yes |
Popular Name: 5-amino-2-[methyl-[2-oxo-2-(1-piperidyl)ethyl]amino]benzoic 5-amino-2-[methyl-[2-oxo-2-(1-pi…
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) | 1.39 | 7.07 | -50.29 | 2 | 6 | -1 | 90 | 290.343 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 6.61 | -43.76 | 3 | 6 | 0 | 91 | 291.351 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.