In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 12 | 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) | -1.14 | 1.06 | -51.42 | 4 | 4 | 1 | 81 | 170.236 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.14 | 0.24 | -12.78 | 3 | 4 | 0 | 79 | 169.228 | 4 | ↓ |