| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 16 | Yes |
Popular Name: (3S)-1-[(3S)-3-(aminomethyl)-1-methyl-pyrrolidin-3-yl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(3S)-3-(aminomethyl)-1-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) | -0.48 | -0.68 | -32.47 | 3 | 4 | 1 | 37 | 227.376 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.48 | -2.38 | -41.44 | 3 | 4 | 1 | 37 | 227.376 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.48 | 2.61 | -179.14 | 5 | 4 | 3 | 40 | 229.392 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.48 | 0.01 | -100.32 | 4 | 4 | 2 | 39 | 228.384 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
