In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 17 | 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) | 1.10 | 5.41 | -6.38 | 2 | 3 | 0 | 46 | 297.196 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 5.73 | -47.99 | 3 | 3 | 1 | 48 | 298.204 | 3 | ↓ |