In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 36 | 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) | 4.02 | 13.39 | -56.65 | 1 | 7 | 1 | 64 | 526.704 | 10 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 10.83 | -17.95 | 0 | 7 | 0 | 62 | 525.696 | 10 | ↓ |