In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | 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) | 1.03 | 4.52 | -47.3 | 2 | 4 | 1 | 40 | 214.333 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.03 | 3.34 | -8.76 | 1 | 4 | 0 | 36 | 213.325 | 3 | ↓ |