In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 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) | 1.54 | 4.24 | -9.36 | 2 | 4 | 0 | 61 | 201.229 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.54 | 4.6 | -30.46 | 3 | 4 | 1 | 62 | 202.237 | 2 | ↓ |