In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2009 | 18 | 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) | 6.05 | 12.41 | -43.28 | 0 | 2 | -1 | 40 | 253.406 | 12 | ↓ |
Lo Low (pH 4.5-6) | 6.05 | 10.44 | -4.99 | 1 | 2 | 0 | 37 | 254.414 | 12 | ↓ |