In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 25 | 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) | 2.30 | 9.18 | -23.51 | 0 | 6 | 0 | 68 | 356.451 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.30 | 9.43 | -41.77 | 1 | 6 | 1 | 69 | 357.459 | 2 | ↓ |