| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 37 | 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) | 2.91 | 9.7 | -51.2 | 2 | 9 | 1 | 98 | 505.595 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 9.86 | -103.29 | 3 | 9 | 2 | 99 | 506.603 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | -1.01 | -59.24 | 1 | 9 | 1 | 94 | 505.595 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | -0.81 | -98.86 | 2 | 9 | 2 | 95 | 506.603 | 8 | ↓ |
