In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 19 | 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) | 2.18 | 6.97 | -40 | 1 | 4 | 1 | 34 | 263.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 6.99 | -44.46 | 1 | 4 | 1 | 34 | 263.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 4.6 | -5.79 | 0 | 4 | 0 | 33 | 262.353 | 5 | ↓ |