In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2007 | 33 | 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) | 7.62 | 13.42 | -10.1 | 1 | 5 | 0 | 64 | 499.419 | 6 | ↓ |
Mid Mid (pH 6-8) | 7.13 | 12.98 | -42.17 | 0 | 5 | -1 | 63 | 498.411 | 7 | ↓ |