In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2009 | 14 | No |
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) | 1.89 | 2.18 | -12.57 | 3 | 3 | 0 | 59 | 206.27 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 2.56 | -33.19 | 4 | 3 | 1 | 60 | 207.278 | 1 | ↓ |