In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2009 | 31 | Yes |
None
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) | 2.04 | -0.12 | -56.8 | 1 | 10 | -1 | 134 | 414.405 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 1.76 | -17.3 | 2 | 10 | 0 | 131 | 415.413 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 4.44 | -16.78 | 2 | 10 | 0 | 128 | 415.413 | 4 | ↓ |