In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 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) | 0.25 | 3.4 | -43.38 | 2 | 3 | 1 | 39 | 181.259 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.25 | 2.06 | -4.4 | 1 | 3 | 0 | 34 | 180.251 | 6 | ↓ |