In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 32 | 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) | 4.81 | 13.28 | -8.47 | 0 | 4 | 0 | 68 | 419.459 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.81 | 12.7 | -46.02 | 1 | 4 | 1 | 69 | 420.467 | 3 | ↓ |