| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 13 | No |
Popular Name: 1-cyclopropyl-2-[methyl-[(3S)-tetrahydrothiophen-3-yl]amino]ethanone 1-cyclopropyl-2-[methyl-[(3S)-te…
| 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) | 1.03 | 7.35 | -40.5 | 1 | 2 | 1 | 22 | 200.327 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.03 | 5.16 | -6.46 | 0 | 2 | 0 | 20 | 199.319 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
