In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2010 | 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) | 4.69 | 9.55 | -11.1 | 0 | 2 | 0 | 18 | 256.736 | 1 | ↓ |
Lo Low (pH 4.5-6) | 4.69 | 9.98 | -25.25 | 1 | 2 | 1 | 19 | 257.744 | 1 | ↓ |