| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 20 | Yes |
Popular Name: [1-(3-cyclopropylpyrazol-1-yl)-3-isoquinolyl]methanamine [1-(3-cyclopropylpyrazol-1-yl)-3…
| 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) | 2.55 | 7.45 | -50.68 | 3 | 4 | 1 | 58 | 265.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 7.04 | -10.15 | 2 | 4 | 0 | 57 | 264.332 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
