In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 15 | 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) | 1.41 | 2.61 | -43.41 | 3 | 3 | 1 | 40 | 215.361 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 4.94 | -87.98 | 4 | 3 | 2 | 41 | 216.369 | 7 | ↓ |