In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 18 | Yes |
Popular Name: 2-[4-(1-amino-1-methyl-ethyl)triazol-1-yl]-1-morpholino-ethanone 2-[4-(1-amino-1-methyl-ethyl)tri…
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) | -0.52 | 0.26 | -63.93 | 3 | 7 | 1 | 88 | 254.314 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.52 | 0 | -19.24 | 2 | 7 | 0 | 86 | 253.306 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.