| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (3S)-1-[3-(cyclohexylamino)propyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[3-(cyclohexylamino)propy…
| 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) | 2.45 | 6.57 | -83.05 | 3 | 3 | 2 | 24 | 255.45 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.45 | 4.17 | -37.69 | 2 | 3 | 1 | 23 | 254.442 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.45 | 8.93 | -187.96 | 4 | 3 | 3 | 25 | 256.458 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
