In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 17 | 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) | 0.59 | 4.57 | -13.34 | 2 | 4 | 0 | 51 | 251.355 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.59 | 4.9 | -46.1 | 3 | 4 | 1 | 53 | 252.363 | 3 | ↓ |