In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | 2.34 | 5.55 | -41.01 | 3 | 3 | 1 | 46 | 267.418 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 4.2 | -8.72 | 2 | 3 | 0 | 41 | 266.41 | 2 | ↓ |