| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 20 | No |
Popular Name: (1S)-1-(1-ethylpyrazol-4-yl)-N-[(3-nitrophenyl)methyl]ethanamine (1S)-1-(1-ethylpyrazol-4-yl)-N-[…
| 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) | 2.14 | 8.17 | -56.55 | 2 | 6 | 1 | 80 | 275.332 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 6.96 | -11.42 | 1 | 6 | 0 | 76 | 274.324 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
