In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 35 | 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) | 6.95 | 15.75 | -37.87 | 1 | 5 | 1 | 51 | 522.119 | 8 | ↓ |
Hi High (pH 8-9.5) | 6.95 | 13.35 | -10.82 | 0 | 5 | 0 | 49 | 521.111 | 8 | ↓ |