In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 14 | Yes |
Popular Name: 2-(cyclopropylamino)-N-(4H-1,2,4-triazol-3-ylmethyl)acetamide 2-(cyclopropylamino)-N-(4H-1,2,4…
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) | -0.97 | 1.59 | -41.36 | 4 | 6 | 1 | 87 | 196.234 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.97 | 0.31 | -11.86 | 3 | 6 | 0 | 83 | 195.226 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.