In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 36 | 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) | 6.01 | 15.93 | -46 | 1 | 6 | 1 | 52 | 491.7 | 9 | ↓ |
Hi High (pH 8-9.5) | 6.01 | 14.03 | -15.7 | 0 | 6 | 0 | 51 | 490.692 | 9 | ↓ |