| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(methylamino)propanamide (2S)-2-cyclopropyl-3-(3,4-dihydr…
| 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) | 1.18 | 4.11 | -49.33 | 4 | 4 | 1 | 63 | 274.388 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 3.84 | -7.88 | 3 | 4 | 0 | 58 | 273.38 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 6.06 | -35.16 | 4 | 4 | 1 | 60 | 274.388 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
