In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 31 | 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) | 3.51 | 1.28 | -49.47 | 1 | 6 | 1 | 66 | 415.469 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 1.34 | -125.12 | 2 | 6 | 2 | 67 | 416.477 | 4 | ↓ |