| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 20 | Yes |
Popular Name: 5-amino-N-[(1S)-1-(2-fluorophenyl)ethyl]-N,3-dimethyl-1H-pyrazole-4-carboxamide 5-amino-N-[(1S)-1-(2-fluoropheny…
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| 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) | 1.12 | 4.83 | -13 | 3 | 5 | 0 | 75 | 276.315 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 4.86 | -13.94 | 3 | 5 | 0 | 75 | 276.315 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 4.98 | -36.29 | 4 | 5 | 1 | 76 | 277.323 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
