In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 13 | 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) | -0.06 | 0.67 | -49.28 | 3 | 4 | 1 | 63 | 207.319 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.06 | -0.69 | -9.09 | 2 | 4 | 0 | 58 | 206.311 | 6 | ↓ |