In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2008 | 23 | 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) | 3.42 | 9.91 | -33.74 | 1 | 3 | 1 | 17 | 311.449 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 9.84 | -34.79 | 1 | 3 | 1 | 17 | 311.449 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 7.52 | -4.45 | 0 | 3 | 0 | 16 | 310.441 | 6 | ↓ |