In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 16th, 2009 | 18 | 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) | 3.17 | 9.24 | -7.94 | 0 | 2 | 0 | 34 | 238.286 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 8.04 | -41.97 | 0 | 2 | -1 | 40 | 237.278 | 4 | ↓ |