In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 8th, 2009 | 23 | 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) | 3.36 | 9.58 | -9.67 | 0 | 4 | 0 | 36 | 332.469 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.36 | 10.02 | -28.03 | 1 | 4 | 1 | 38 | 333.477 | 6 | ↓ |