In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 20 | 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) | 3.71 | 1.76 | -11.66 | 0 | 3 | 0 | 45 | 260.296 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.71 | 2.34 | -34.38 | 1 | 3 | 1 | 47 | 261.304 | 2 | ↓ |