In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 28 | 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) | 0.49 | 2.17 | -15.59 | 3 | 9 | 0 | 126 | 433.845 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 0.35 | -63.86 | 2 | 9 | -1 | 129 | 432.837 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.49 | 2.57 | -65.61 | 4 | 9 | 1 | 127 | 434.853 | 8 | ↓ |