In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 23 | 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) | -1.98 | -5.1 | -17.82 | 5 | 10 | 0 | 157 | 333.272 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.52 | -6.76 | -58.04 | 4 | 10 | -1 | 160 | 332.264 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.98 | -4.78 | -58.64 | 6 | 10 | 1 | 159 | 334.28 | 5 | ↓ |