In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 25 | 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) | 3.73 | 11.1 | -37.69 | 1 | 3 | 1 | 17 | 337.487 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 11.09 | -36.13 | 1 | 3 | 1 | 17 | 337.487 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 8.72 | -5.44 | 0 | 3 | 0 | 16 | 336.479 | 6 | ↓ |