In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 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) | 3.39 | 7.23 | -31.95 | 3 | 3 | 1 | 43 | 242.412 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.39 | 4.75 | -4.88 | 2 | 3 | 0 | 42 | 241.404 | 8 | ↓ |