In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 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) | 3.95 | 11.08 | -9.1 | 1 | 3 | 0 | 32 | 310.441 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.95 | 11.19 | -27.35 | 2 | 3 | 0 | 34 | 311.449 | 5 | ↓ |