In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 22nd, 2008 | 15 | 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) | 0.30 | 2.73 | -38.01 | 5 | 6 | 1 | 86 | 209.277 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 3.06 | -82.71 | 6 | 6 | 2 | 87 | 210.285 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 3.24 | -180.04 | 7 | 6 | 3 | 88 | 211.293 | 1 | ↓ |