In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 27 | 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) | 2.51 | 5.45 | -14.59 | 1 | 6 | 0 | 62 | 379.545 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 7.4 | -47.55 | 2 | 6 | 1 | 63 | 380.553 | 6 | ↓ |