In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 12 | 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) | 1.18 | 0.89 | -7.05 | 1 | 3 | 0 | 42 | 167.208 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.18 | 1.16 | -31.04 | 2 | 3 | 1 | 44 | 168.216 | 2 | ↓ |