| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: 2-amino-N,3-dimethyl-N-{5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl}butanamide 2-amino-N,3-dimethyl-N-{5H,6H,7H…
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CAS Number: 1218462-71-5
| 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) | -0.91 | 4.64 | -51.52 | 3 | 6 | 1 | 79 | 252.342 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.91 | 4.26 | -19.61 | 2 | 6 | 0 | 77 | 251.334 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
![6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole](http://zinc12.docking.org/img/rings/3616.gif)
