In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2005 | 31 | 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) | -5.03 | -3.56 | -328.48 | 3 | 18 | -4 | 287 | 503.235 | 8 | ↓ |
Mid Mid (pH 6-8) | -5.03 | -4.71 | -197.79 | 4 | 18 | -3 | 284 | 504.243 | 8 | ↓ |