In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 24 | 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) | 4.21 | 11 | -35.48 | 1 | 3 | 1 | 17 | 325.476 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 8.69 | -4.54 | 0 | 3 | 0 | 16 | 324.468 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.21 | 11.06 | -39.2 | 1 | 3 | 1 | 17 | 325.476 | 7 | ↓ |