| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | No |
Popular Name: 2-[(6-chloro-3-nitro-2-pyridyl)sulfanyl]pyrimidin-4-ol 2-[(6-chloro-3-nitro-2-pyridyl)s…
| 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) | 2.11 | 4.95 | -11.28 | 1 | 7 | 0 | 104 | 284.684 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 3.23 | -47.81 | 0 | 7 | -1 | 108 | 283.676 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 4.63 | -21.94 | 1 | 7 | 0 | 104 | 284.684 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
