In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2008 | 12 | 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) | 2.14 | 5.23 | -41.62 | 0 | 2 | -1 | 40 | 167.228 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 5.26 | -7.96 | 0 | 2 | 0 | 34 | 168.236 | 1 | ↓ |