In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2006 | 28 | No |
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) | 1.64 | 7 | -66.84 | 1 | 6 | -1 | 90 | 381.383 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.06 | -0.93 | -18.71 | 1 | 6 | 0 | 83 | 382.391 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.09 | -0.9 | -22.92 | 2 | 6 | 0 | 86 | 382.391 | 5 | ↓ |