In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 14 | 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) | 2.93 | 7.08 | -44.94 | 2 | 1 | 1 | 17 | 214.691 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.93 | 5.79 | -3.28 | 1 | 1 | 0 | 12 | 213.683 | 3 | ↓ |