In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 17 | 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) | 2.42 | 4.63 | -14.89 | 1 | 3 | 0 | 42 | 263.602 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 3.19 | -34.83 | 0 | 3 | -1 | 45 | 262.594 | 2 | ↓ |