In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2006 | 18 | 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) | 1.24 | 6 | -12.58 | 0 | 6 | 0 | 95 | 240.222 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 6.27 | -38.22 | 1 | 6 | 1 | 97 | 241.23 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 6.27 | -44.67 | 1 | 6 | 1 | 97 | 241.23 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 6.53 | -102.5 | 2 | 6 | 2 | 98 | 242.238 | 3 | ↓ |