In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2008 | 24 | 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) | 4.01 | 8.9 | -28.15 | 1 | 3 | 1 | 21 | 318.444 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.01 | 11.22 | -87.17 | 2 | 3 | 2 | 22 | 319.452 | 3 | ↓ |