In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 23 | 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) | 3.68 | 8.08 | -44.13 | 4 | 3 | 1 | 51 | 311.449 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.68 | 5.12 | -5.01 | 3 | 3 | 0 | 49 | 310.441 | 6 | ↓ |