In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 13 | No |
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) | -0.43 | -2.04 | -13.7 | 2 | 4 | 0 | 73 | 218.303 | 1 | ↓ |
Lo Low (pH 4.5-6) | -0.43 | -1.79 | -64.39 | 3 | 4 | 1 | 75 | 219.311 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.