In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 25 | No |
None
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) | 3.63 | 9.42 | -9.76 | 1 | 5 | 0 | 63 | 373.865 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.16 | 8.32 | -45.55 | 0 | 5 | -1 | 65 | 372.857 | 6 | ↓ |