| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 17 | Yes |
Popular Name: (3S)-1-[(1R)-2-amino-1-(1-methylpyrazol-4-yl)ethyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(1R)-2-amino-1-(1-methyl…
| 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) | -0.74 | 2.06 | -92.84 | 4 | 5 | 2 | 53 | 239.367 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.74 | -0.48 | -5.24 | 2 | 5 | 0 | 50 | 237.351 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.74 | -0.33 | -47.98 | 3 | 5 | 1 | 52 | 238.359 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
