| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 18 | Yes |
Popular Name: 5-amino-3-methyl-N-(3-methyl-4-pyridyl)imidazole-4-sulfonamide 5-amino-3-methyl-N-(3-methyl-4-p…
| 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) | -0.03 | 1.73 | -42.12 | 2 | 7 | -1 | 104 | 266.306 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.20 | 2.24 | -44.96 | 3 | 7 | 0 | 106 | 267.314 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.20 | 1.74 | -42.99 | 2 | 7 | -1 | 105 | 266.306 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.03 | 2.71 | -44.63 | 4 | 7 | 1 | 107 | 268.322 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.03 | 2.02 | -40.91 | 4 | 7 | 1 | 108 | 268.322 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.03 | 2.21 | -27.47 | 3 | 7 | 0 | 106 | 267.314 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
