In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 16 | 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) | -0.38 | 3.2 | -49.47 | 4 | 4 | 1 | 60 | 242.368 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.19 | 1.66 | -47.4 | 3 | 4 | 0 | 66 | 241.36 | 3 | ↓ |