In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 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) | 3.04 | 7.62 | -50.39 | 2 | 2 | 1 | 26 | 246.305 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 6.27 | -6.94 | 1 | 2 | 0 | 21 | 245.297 | 5 | ↓ |