In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 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) | 2.06 | 7.45 | -54.89 | 0 | 4 | -1 | 56 | 241.27 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 7.9 | -74.23 | 1 | 4 | 0 | 58 | 242.278 | 4 | ↓ |