In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 15 | 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) | 3.07 | 6.01 | -47.98 | 1 | 3 | -1 | 60 | 213.297 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.07 | 4.04 | -6.42 | 2 | 3 | 0 | 58 | 214.305 | 2 | ↓ |