In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2011 | 23 | No |
None
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) | -4.35 | -4.27 | -352.4 | 3 | 13 | -4 | 224 | 377.135 | 6 | ↓ |
Mid Mid (pH 6-8) | -4.35 | -5.43 | -222.72 | 4 | 13 | -3 | 221 | 378.143 | 6 | ↓ |
Lo Low (pH 4.5-6) | -4.35 | -6.58 | -111.96 | 5 | 13 | -2 | 218 | 379.151 | 6 | ↓ |