In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 26 | 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) | 3.40 | 8.63 | -13.9 | 1 | 4 | 0 | 49 | 358.526 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 8.14 | -44.24 | 1 | 4 | 1 | 51 | 359.534 | 2 | ↓ |