| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: (3S)-N,N-dimethyl-1-[[4-(propylaminomethyl)tetrahydropyran-4-yl]methyl]pyrrolidin-3-amine (3S)-N,N-dimethyl-1-[[4-(propyla…
| 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) | 1.26 | 5.93 | -92 | 3 | 4 | 2 | 34 | 285.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.26 | 3.54 | -41.17 | 2 | 4 | 1 | 32 | 284.468 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.26 | 7.85 | -202.53 | 4 | 4 | 3 | 35 | 286.484 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
