In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | 0.54 | 3.8 | -50.38 | 3 | 6 | 1 | 71 | 291.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 4.13 | -88.99 | 4 | 6 | 2 | 72 | 292.383 | 3 | ↓ |