In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2006 | 23 | 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) | 4.53 | 10.29 | -7.59 | 0 | 3 | 0 | 25 | 322.433 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.53 | 10.69 | -24.94 | 1 | 3 | 1 | 27 | 323.441 | 3 | ↓ |