In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 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) | 4.00 | 8.13 | -11.23 | 1 | 3 | 0 | 42 | 302.175 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 7.68 | -37.64 | 0 | 3 | -1 | 40 | 301.167 | 2 | ↓ |