In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2006 | 15 | 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) | 1.52 | 3.21 | -17.83 | 1 | 5 | 0 | 72 | 204.233 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 2.1 | -43.7 | 0 | 5 | -1 | 75 | 203.225 | 1 | ↓ |