In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 18 | 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) | 1.63 | 2.87 | -12.28 | 2 | 5 | 0 | 78 | 238.25 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 3.45 | -32.65 | 3 | 5 | 1 | 79 | 239.258 | 2 | ↓ |