In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 19 | No |
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) | 1.16 | 1.37 | -21.17 | 3 | 5 | 0 | 68 | 279.365 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 3.64 | -58.11 | 4 | 5 | 1 | 69 | 280.373 | 4 | ↓ |