In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2007 | 17 | No |
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) | 1.84 | 5.02 | -8.28 | 1 | 3 | 0 | 46 | 222.247 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.84 | 5.3 | -43.59 | 2 | 3 | 1 | 47 | 223.255 | 1 | ↓ |