In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 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) | 4.66 | 9.45 | -32.7 | 2 | 2 | 1 | 25 | 310.461 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.66 | 7.53 | -2.36 | 1 | 2 | 0 | 23 | 309.453 | 2 | ↓ |