In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 35 | 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) | 4.07 | 13.28 | -58.08 | 1 | 6 | 1 | 54 | 476.572 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 10.93 | -22.38 | 0 | 6 | 0 | 53 | 475.564 | 7 | ↓ |