In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 16 | 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) | 0.89 | -0.24 | -14.86 | 4 | 5 | 0 | 92 | 222.244 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.89 | 0.76 | -58.62 | 3 | 5 | -1 | 95 | 221.236 | 5 | ↓ |