In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 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) | 3.79 | 8.6 | -15.47 | 1 | 3 | 0 | 42 | 373.225 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.79 | 8.96 | -41.48 | 2 | 3 | 1 | 43 | 374.233 | 4 | ↓ |