| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2011 | 12 | Yes |
Popular Name: N-[[(3S)-3-methylpyrrolidin-3-yl]methyl]cyclobutanamine N-[[(3S)-3-methylpyrrolidin-3-yl…
| 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) | 1.29 | 4.24 | -97.41 | 4 | 2 | 2 | 33 | 170.3 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 2.73 | -34.95 | 3 | 2 | 1 | 29 | 169.292 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 3.15 | -36.61 | 3 | 2 | 1 | 29 | 169.292 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
