In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 29 | 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) | 3.04 | 7.01 | -57.19 | 0 | 7 | -1 | 88 | 394.403 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.04 | 6.3 | -14.69 | 1 | 7 | 0 | 85 | 395.411 | 5 | ↓ |