In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 32 | 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) | -4.96 | 2.28 | -149.78 | 10 | 14 | 0 | 252 | 457.488 | 13 | ↓ |
Hi High (pH 8-9.5) | -4.96 | 1.87 | -128.59 | 9 | 14 | -1 | 251 | 456.48 | 13 | ↓ |