In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 36 | No |
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) | 9.82 | 23.32 | -6.06 | 0 | 2 | 0 | 26 | 492.836 | 23 | ↓ |
Lo Low (pH 4.5-6) | 9.82 | 23.67 | -31.24 | 1 | 2 | 1 | 27 | 493.844 | 23 | ↓ |