In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2008 | 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) | 3.12 | 7.01 | -7.97 | 0 | 3 | 0 | 31 | 241.29 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 6.64 | -37.67 | 1 | 3 | 1 | 32 | 242.298 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 7.36 | -35.51 | 1 | 3 | 1 | 32 | 242.298 | 4 | ↓ |