| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | No |
Popular Name: (3S)-1-[3-[4-(chloromethyl)thiazol-2-yl]propyl]-N,N-diethyl-pyrrolidin-3-amine (3S)-1-[3-[4-(chloromethyl)thiaz…
| 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) | 2.80 | 9.64 | -110.37 | 2 | 3 | 2 | 22 | 317.93 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 7.49 | -40.01 | 1 | 3 | 1 | 21 | 316.922 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 7.22 | -36 | 1 | 3 | 1 | 21 | 316.922 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
