In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | 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) | 3.34 | 5.87 | -10.21 | 2 | 4 | 0 | 54 | 255.321 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.32 | -37.18 | 3 | 4 | 1 | 55 | 256.329 | 3 | ↓ |