In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 27 | 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) | 5.30 | 11.87 | -10.39 | 0 | 4 | 0 | 36 | 358.441 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.30 | 12.38 | -32.68 | 1 | 4 | 1 | 38 | 359.449 | 7 | ↓ |