In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 28 | 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) | -1.36 | 5.58 | -96.64 | 3 | 7 | 0 | 102 | 393.39 | 5 | ↓ |
Lo Low (pH 4.5-6) | -4.10 | 4.63 | -70.42 | 4 | 7 | 1 | 105 | 394.398 | 4 | ↓ |