In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 33 | 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) | 4.91 | 10.6 | -15.3 | 2 | 9 | 0 | 130 | 491.932 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.10 | 8.85 | -38.21 | 1 | 9 | -1 | 136 | 490.924 | 8 | ↓ |