In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 13 | 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) | 1.08 | 0.34 | -3.42 | 1 | 3 | 0 | 33 | 187.283 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 2.51 | -31.21 | 2 | 3 | 1 | 34 | 188.291 | 3 | ↓ |