In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 19 | 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) | 6.29 | 13.08 | -43.42 | 0 | 2 | -1 | 40 | 267.433 | 13 | ↓ |
Lo Low (pH 4.5-6) | 6.29 | 11.1 | -5.17 | 1 | 2 | 0 | 37 | 268.441 | 13 | ↓ |