| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: (3R)-1-[[4-(aminomethyl)phenyl]methylsulfonyl]-N,N-dimethyl-pyrrolidin-3-amine (3R)-1-[[4-(aminomethyl)phenyl]m…
| 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) | 0.65 | 3.46 | -96.49 | 4 | 5 | 2 | 69 | 299.44 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | 0.67 | -11.59 | 2 | 5 | 0 | 67 | 297.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.65 | 1.07 | -52.17 | 3 | 5 | 1 | 68 | 298.432 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
