In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | 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) | 2.52 | 7.04 | -34.3 | 2 | 2 | 1 | 16 | 219.352 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.52 | 8.26 | -113.18 | 3 | 2 | 2 | 21 | 220.36 | 5 | ↓ |