| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 15 | Yes |
Popular Name: (3S)-1-[(5-chlorothiadiazol-4-yl)methyl]-N,N-dimethyl-pyrrolidin-3-amine (3S)-1-[(5-chlorothiadiazol-4-yl…
| 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) | 1.52 | 3.09 | -37.13 | 1 | 4 | 1 | 33 | 247.775 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 0.7 | -3.37 | 0 | 4 | 0 | 32 | 246.767 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
