| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (3S)-N,N-dimethyl-1-[(3R,4S)-4-(propylamino)tetrahydropyran-3-yl]pyrrolidin-3-amine (3S)-N,N-dimethyl-1-[(3R,4S)-4-(…
| 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) | 1.25 | 3.98 | -91.95 | 3 | 4 | 2 | 34 | 257.422 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 3.94 | -32.83 | 2 | 4 | 1 | 29 | 256.414 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 1.54 | -1.6 | 1 | 4 | 0 | 28 | 255.406 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 1.58 | -35.69 | 2 | 4 | 1 | 32 | 256.414 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
