In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2010 | 37 | 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) | 6.18 | 14.75 | -105.8 | 3 | 5 | 2 | 65 | 510.037 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.18 | 12.67 | -36.2 | 2 | 5 | 1 | 63 | 509.029 | 4 | ↓ |