In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2009 | 13 | Yes |
Popular Name: 1-(pyridin-4-ylmethyl)-1H-1,2,4-triazol-3-amine 1-(pyridin-4-ylmethyl)-1H-1,2,4-…
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CAS Number: 1182736-00-0
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) | -0.43 | 5.41 | -11.97 | 2 | 5 | 0 | 70 | 175.195 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 156 - 158 | Enamine Building Blocks |
MP | 156...158 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.