In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 21 | 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) | 1.39 | 7.47 | -19.63 | 0 | 5 | 0 | 55 | 303.387 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 7.95 | -48.47 | 1 | 5 | 1 | 56 | 304.395 | 1 | ↓ |