In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 29 | 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) | 3.12 | 11.23 | -49.43 | 1 | 5 | 1 | 43 | 460.392 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 9 | -13.64 | 0 | 5 | 0 | 42 | 459.384 | 4 | ↓ |