In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 17 | Yes |
Popular Name: 1-[[5-(3-aminoprop-1-ynyl)-2-thienyl]methyl]-3-methyl-imidazolidin-2-one 1-[[5-(3-aminoprop-1-ynyl)-2-thi…
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) | 0.64 | 4.56 | -12.81 | 2 | 4 | 0 | 50 | 249.339 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 4.97 | -56.25 | 3 | 4 | 1 | 51 | 250.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.