In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2009 | 14 | 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) | -0.43 | 3.16 | -43.26 | 1 | 7 | -1 | 90 | 188.174 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.43 | 3.24 | -15.36 | 2 | 7 | 0 | 92 | 189.182 | 3 | ↓ |