In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 14 | 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) | 0.93 | -0.04 | -45.23 | 2 | 5 | -1 | 94 | 193.134 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.93 | -1.13 | -16.3 | 3 | 5 | 0 | 91 | 194.142 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.93 | -0.92 | -8.84 | 3 | 5 | 0 | 91 | 194.142 | 0 | ↓ |