In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2008 | 18 | Yes |
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) | 2.01 | 1.42 | -11.03 | 0 | 6 | 0 | 62 | 250.302 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 1.68 | -47.79 | 1 | 6 | 1 | 63 | 251.31 | 4 | ↓ |