In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 15 | 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) | 2.36 | 5.76 | -41.7 | 2 | 2 | 1 | 26 | 206.309 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 4.57 | -3.67 | 1 | 2 | 0 | 21 | 205.301 | 1 | ↓ |