In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2008 | 26 | 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) | 2.56 | 7.59 | -23.17 | 2 | 5 | 0 | 71 | 345.402 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 8.03 | -56.58 | 3 | 5 | 1 | 72 | 346.41 | 5 | ↓ |