In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 15 | 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) | -2.00 | 3.73 | -71.85 | 2 | 6 | 0 | 86 | 216.237 | 3 | ↓ |
Hi High (pH 8-9.5) | -2.00 | 2.43 | -58.76 | 1 | 6 | -1 | 82 | 215.229 | 3 | ↓ |