In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 18 | 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) | 3.70 | 8.29 | -58.72 | 0 | 3 | -1 | 53 | 236.25 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 8.67 | -48.58 | 1 | 3 | 0 | 54 | 237.258 | 1 | ↓ |