In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2011 | 35 | No |
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) | -2.24 | -12.9 | -16.65 | 8 | 14 | 0 | 225 | 506.457 | 8 | ↓ |
Mid Mid (pH 6-8) | -2.24 | -12.18 | -43.54 | 7 | 14 | -1 | 228 | 505.449 | 8 | ↓ |