In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2010 | 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) | 1.28 | 4.83 | -48.73 | 2 | 5 | 0 | 76 | 224.26 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.28 | 4.36 | -47.94 | 1 | 5 | -1 | 74 | 223.252 | 7 | ↓ |