In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2004 | 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) | 1.47 | -1.35 | -17.43 | 5 | 10 | 0 | 155 | 482.441 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.47 | -0.35 | -56.17 | 4 | 10 | -1 | 158 | 481.433 | 4 | ↓ |