| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2010 | 11 | Yes |
Popular Name: 1H-Pyrazole-5-methanamine, 4-ethynyl-1,3-dimethyl- (9CI) 1H-Pyrazole-5-methanamine, 4-eth…
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CAS Number: 50847-41-1
| 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) | -0.28 | 1.87 | -49.78 | 3 | 3 | 1 | 45 | 150.205 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.28 | 1.47 | -7.19 | 2 | 3 | 0 | 44 | 149.197 | 1 | ↓ |
