| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 17 | Yes |
Popular Name: (3S)-1-[(5-chlorothiadiazol-4-yl)methyl]-N,N-diethyl-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) | 2.28 | 4.07 | -34.87 | 1 | 4 | 1 | 33 | 275.829 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.28 | 1.95 | -2.99 | 0 | 4 | 0 | 32 | 274.821 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
