In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 4th, 2005 | 17 | 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) | -1.13 | -4.9 | -36.67 | 1 | 8 | -1 | 115 | 260.251 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.59 | -3.16 | -16.95 | 2 | 8 | 0 | 112 | 261.259 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.13 | -5.71 | -50.04 | 1 | 8 | -1 | 115 | 260.251 | 2 | ↓ |