In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 29 | 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) | 4.97 | -0.6 | -20.96 | 1 | 7 | 0 | 100 | 404.451 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.97 | -0.51 | -50.41 | 2 | 7 | 1 | 101 | 405.459 | 4 | ↓ |