In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 34 | 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) | 6.72 | 11.99 | -10.51 | 2 | 5 | 0 | 69 | 492.406 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.72 | 12.76 | -49.11 | 1 | 5 | -1 | 72 | 491.398 | 5 | ↓ |