In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 21 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-[1-(2-methoxyethyl)pyrazol-4-yl]thiophene-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-[1-(2-m…
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) | 0.33 | 2.84 | -60.94 | 4 | 6 | 1 | 84 | 305.383 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.33 | 2.43 | -11.89 | 3 | 6 | 0 | 82 | 304.375 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.