In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 33 | 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) | 7.27 | 14.09 | -19.49 | 1 | 5 | 0 | 72 | 476.623 | 7 | ↓ |
Mid Mid (pH 6-8) | 7.72 | 12.86 | -48.9 | 0 | 5 | -1 | 75 | 475.615 | 7 | ↓ |