In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 15 | Yes |
Popular Name: 1-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[(1-methyltriazol-4-yl)methyl]methanamine 1-(3-methyl-1,2,4-oxadiazol-5-yl…
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) | -0.87 | -1.15 | -14.38 | 1 | 7 | 0 | 82 | 208.225 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.87 | 0.22 | -54.29 | 2 | 7 | 1 | 86 | 209.233 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.