In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 16 | 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) | 1.90 | 4.47 | -10.17 | 1 | 3 | 0 | 38 | 225.263 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.97 | 3.16 | -34.9 | 2 | 3 | 1 | 43 | 226.271 | 6 | ↓ |