In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 5th, 2008 | 28 | 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) | 3.89 | 10.3 | -10.46 | 0 | 3 | 0 | 24 | 406.473 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 12.63 | -57.09 | 1 | 3 | 1 | 25 | 407.481 | 4 | ↓ |