In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 33 | 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) | -1.27 | -1.03 | -14.17 | 6 | 12 | 0 | 172 | 457.491 | 7 | ↓ |
Mid Mid (pH 6-8) | -1.27 | -0.74 | -57.3 | 7 | 12 | 1 | 174 | 458.499 | 7 | ↓ |