| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 20 | Yes |
Popular Name: (R)-1-isoquinolyl-(1-propylimidazol-2-yl)methanamine (R)-1-isoquinolyl-(1-propylimida…
| 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) | 2.29 | 6.38 | -27.44 | 3 | 4 | 1 | 58 | 267.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 6.5 | -24.88 | 3 | 4 | 1 | 58 | 267.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 5.94 | -11.23 | 2 | 4 | 0 | 57 | 266.348 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 6.95 | -84.18 | 4 | 4 | 2 | 59 | 268.364 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.29 | 6.27 | -40.14 | 3 | 4 | 1 | 58 | 267.356 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
