In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: 4-[[(3R)-3-(diethylamino)pyrrolidin-1-yl]methyl]-N-propyl-thiadiazol-5-amine 4-[[(3R)-3-(diethylamino)pyrroli…
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) | 2.33 | 4.17 | -39.01 | 2 | 5 | 1 | 45 | 298.48 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 2.12 | -5.96 | 1 | 5 | 0 | 44 | 297.472 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.