In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2011 | 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) | 1.16 | 6.21 | -57.78 | 2 | 6 | -1 | 99 | 290.343 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 6.65 | -54.69 | 3 | 6 | 0 | 101 | 291.351 | 6 | ↓ |