| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2R)-2-amino-2-cyclopropyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)propanoic (2R)-2-amino-2-cyclopropyl-3-(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) | -0.66 | 6.19 | -35.72 | 3 | 4 | 0 | 71 | 260.337 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.66 | 6.19 | -50.21 | 2 | 4 | -1 | 69 | 259.329 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.66 | 7.77 | -37.21 | 3 | 4 | 0 | 71 | 260.337 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.66 | 7.96 | -73.55 | 4 | 4 | 1 | 72 | 261.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
