| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: (3S)-N,N-diethyl-1-[[4-(ethylaminomethyl)tetrahydropyran-4-yl]methyl]pyrrolidin-3-amine (3S)-N,N-diethyl-1-[[4-(ethylami…
| 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) | 1.51 | 5.95 | -87.08 | 3 | 4 | 2 | 34 | 299.503 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 3.85 | -38.18 | 2 | 4 | 1 | 32 | 298.495 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.51 | 8.02 | -203.84 | 4 | 4 | 3 | 35 | 300.511 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
