| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 16 | Yes |
Popular Name: N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-3-methoxy-N-methyl-propan-1-amine N-[2-[4-(aminomethyl)triazol-1-y…
| 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) | -0.44 | 1.64 | -102.49 | 4 | 6 | 2 | 72 | 229.328 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | 1.24 | -46.87 | 3 | 6 | 1 | 70 | 228.32 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.44 | -0.68 | -49.28 | 3 | 6 | 1 | 71 | 228.32 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
