In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 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) | 1.87 | 5.27 | -10.65 | 1 | 4 | 0 | 58 | 239.278 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.87 | 5.65 | -43.15 | 2 | 4 | 1 | 59 | 240.286 | 5 | ↓ |