In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 11 | 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) | 2.03 | 3.95 | -5.35 | 0 | 2 | 0 | 27 | 152.241 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 6.3 | -43.31 | 1 | 2 | 1 | 28 | 153.249 | 2 | ↓ |