In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 25 | 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) | 3.76 | -2.21 | -36.78 | 3 | 4 | 1 | 59 | 328.395 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.76 | -2.02 | -77.93 | 4 | 4 | 2 | 60 | 329.403 | 4 | ↓ |