In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 39 | 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) | 5.63 | 15.85 | -18.53 | 1 | 7 | 0 | 75 | 527.665 | 14 | ↓ |
Mid Mid (pH 6-8) | 5.63 | 16.34 | -43.12 | 2 | 7 | 1 | 76 | 528.673 | 14 | ↓ |