In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 19 | 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) | 1.67 | 1.26 | -106.67 | 1 | 7 | -2 | 121 | 298.301 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 1.46 | -59.9 | 2 | 7 | -1 | 119 | 299.309 | 4 | ↓ |