In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 17 | Yes |
Popular Name: 4-amino-N-methyl-N-(3-pyridylmethyl)-1,2,5-oxadiazole-3-carboxamide 4-amino-N-methyl-N-(3-pyridylmet…
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) | -0.16 | 2.39 | -9.54 | 2 | 7 | 0 | 98 | 233.231 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.16 | 2.85 | -38.16 | 3 | 7 | 1 | 99 | 234.239 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.