In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2009 | 29 | 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) | 3.30 | 11.61 | -41.96 | 1 | 6 | 1 | 63 | 428.607 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.30 | 11.3 | -13.63 | 0 | 6 | 0 | 62 | 427.599 | 5 | ↓ |