In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 13 | No |
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) | 0.40 | 3.12 | -45.93 | 0 | 4 | -1 | 53 | 204.633 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.40 | 5.44 | -47.93 | 1 | 4 | 0 | 54 | 205.641 | 3 | ↓ |