In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 13 | 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) | 2.33 | 2.66 | -6.14 | 2 | 3 | 0 | 52 | 194.259 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 2.52 | -27.13 | 3 | 3 | 1 | 53 | 195.267 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.