| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 21 | Yes |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-methoxy-1,3-dimethyl-pyrazol-4-yl)methanamine N-(1,3-benzodioxol-5-ylmethyl)-1…
| 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) | 1.56 | 4.01 | -50.8 | 2 | 6 | 1 | 62 | 290.343 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 2.66 | -10.04 | 1 | 6 | 0 | 58 | 289.335 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
