In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 17th, 2008 | 19 | 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) | 3.75 | 6.87 | -9.59 | 0 | 3 | 0 | 31 | 253.301 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.75 | 7.24 | -28.88 | 1 | 3 | 1 | 33 | 254.309 | 2 | ↓ |