| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 18 | Yes |
Popular Name: 4-amino-2-[(4-methyl-1,2,4-triazol-3-yl)methylamino]benzoic 4-amino-2-[(4-methyl-1,2,4-triaz…
| 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) | -0.08 | 4.84 | -59.08 | 3 | 7 | -1 | 109 | 246.25 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.08 | 2.86 | -15.84 | 4 | 7 | 0 | 106 | 247.258 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
