In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 27th, 2007 | 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) | 2.76 | -0.58 | -65.71 | 0 | 4 | -1 | 65 | 263.276 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | -0.3 | -42.29 | 1 | 4 | 0 | 67 | 264.284 | 2 | ↓ |