In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2008 | 26 | 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) | 4.73 | 9.48 | -15.1 | 0 | 3 | 0 | 47 | 359.45 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.73 | 9.68 | -36.17 | 1 | 3 | 1 | 48 | 360.458 | 3 | ↓ |