| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 18 | Yes |
Popular Name: 3-[[(1S)-1-cyclopentylethyl]amino]-1-isopropyl-pyrazin-2-one 3-[[(1S)-1-cyclopentylethyl]amin…
| 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) | 2.58 | 7.3 | -7.62 | 1 | 4 | 0 | 47 | 249.358 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 7.63 | -31.31 | 2 | 4 | 1 | 48 | 250.366 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
