In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 29 | 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) | 4.92 | 10.35 | -16.91 | 1 | 6 | 0 | 75 | 493.452 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.10 | 8.97 | -41.04 | 0 | 6 | -1 | 82 | 492.444 | 8 | ↓ |