In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 21 | 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) | 3.72 | 9.26 | -47.48 | 1 | 3 | -1 | 60 | 283.347 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.72 | 7.28 | -9.43 | 2 | 3 | 0 | 58 | 284.355 | 7 | ↓ |