In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 17 | 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) | 2.29 | 8.46 | -70.76 | 0 | 4 | -1 | 62 | 250.661 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.99 | 6.7 | -40.64 | 1 | 4 | 0 | 64 | 251.669 | 2 | ↓ |