In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 21 | 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) | 1.00 | 5.93 | -34.74 | 3 | 4 | 1 | 49 | 293.431 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 6.23 | -121.34 | 4 | 4 | 2 | 51 | 294.439 | 5 | ↓ |