In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 14 | 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) | 1.53 | 4.82 | -46.32 | 3 | 2 | 1 | 41 | 191.298 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.53 | 5.29 | -103.17 | 4 | 2 | 2 | 42 | 192.306 | 3 | ↓ |