In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 28 | 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) | 7.04 | 13.76 | -17.71 | 0 | 2 | 0 | 26 | 360.46 | 2 | ↓ |
Lo Low (pH 4.5-6) | 7.04 | 14.18 | -25.83 | 1 | 2 | 1 | 27 | 361.468 | 2 | ↓ |