In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 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) | 1.20 | 2.25 | -43.96 | 3 | 3 | 1 | 44 | 260.155 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 4.51 | -108.99 | 4 | 3 | 2 | 45 | 261.163 | 2 | ↓ |