In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 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) | 4.96 | 8.89 | -118.74 | 4 | 2 | 2 | 32 | 258.494 | 12 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 7.2 | -43.91 | 3 | 2 | 1 | 31 | 257.486 | 12 | ↓ |