In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2006 | 23 | 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) | 4.22 | 6.95 | -14.43 | 2 | 6 | 0 | 93 | 316.309 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.22 | 7.94 | -55.93 | 1 | 6 | -1 | 96 | 315.301 | 8 | ↓ |