| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: (1S)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1S)-N-[(4-methyl-1,2,5-oxadiazo…
| 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) | 0.00 | 3.01 | -20.73 | 1 | 7 | 0 | 82 | 222.252 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.00 | 4.17 | -58.73 | 2 | 7 | 1 | 86 | 223.26 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
