In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 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) | 0.88 | 4.21 | -103.78 | 4 | 3 | 2 | 41 | 210.321 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 4.75 | -43.83 | 3 | 3 | 1 | 44 | 209.313 | 6 | ↓ |