In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2010 | 20 | 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) | 3.17 | 10.6 | -14.99 | 1 | 5 | 0 | 58 | 267.336 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 11.09 | -32.04 | 2 | 5 | 1 | 59 | 268.344 | 4 | ↓ |