In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 18 | Yes |
Popular Name: 1-(1-methyltriazol-4-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)methanamine 1-(1-methyltriazol-4-yl)-N-([1,2…
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) | -0.02 | 3.76 | -19.27 | 1 | 7 | 0 | 73 | 243.274 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.02 | 5.12 | -56.33 | 2 | 7 | 1 | 78 | 244.282 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.