In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 26th, 2008 | 21 | 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) | -3.26 | 5.82 | -192.86 | 2 | 9 | -3 | 162 | 301.275 | 9 | ↓ |
Lo Low (pH 4.5-6) | -3.26 | 3.91 | -128.39 | 3 | 9 | -2 | 159 | 302.283 | 9 | ↓ |