In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2007 | 32 | 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) | 4.26 | 18 | -14.41 | 0 | 7 | 0 | 66 | 427.508 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.26 | 18.48 | -38.97 | 1 | 7 | 1 | 67 | 428.516 | 6 | ↓ |