In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2009 | 37 | 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) | -5.13 | 0.7 | -175.38 | 14 | 15 | 2 | 269 | 529.643 | 16 | ↓ |
Hi High (pH 8-9.5) | -5.13 | -0.41 | -132.4 | 13 | 15 | 1 | 267 | 528.635 | 16 | ↓ |
Mid Mid (pH 6-8) | -5.09 | 0.31 | -126.07 | 13 | 15 | 1 | 265 | 528.635 | 17 | ↓ |