| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: 4-(aminomethyl)-N-(3-furylmethyl)-N,2,5-trimethyl-pyrazol-3-amine 4-(aminomethyl)-N-(3-furylmethyl…
| 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) | 0.29 | 4.22 | -47.66 | 3 | 5 | 1 | 62 | 235.311 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.29 | 3.82 | -7.14 | 2 | 5 | 0 | 60 | 234.303 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | 4.35 | -101.17 | 4 | 5 | 2 | 63 | 236.319 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
