In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 18 | Yes |
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) | 3.66 | 7.73 | -7.64 | 0 | 2 | 0 | 22 | 235.286 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 8 | -38.58 | 1 | 2 | 1 | 23 | 236.294 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.