| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | No |
Popular Name: (2S)-2-cyclopropyl-3-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-2-(ethylamino)propanoic (2S)-2-cyclopropyl-3-[[(3R)-1,1-…
| 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) | -1.78 | 4.55 | -93.93 | 3 | 6 | 1 | 95 | 305.42 | 7 | ↓ |
| Hi High (pH 8-9.5) | -1.78 | 4.36 | -45.28 | 2 | 6 | 0 | 91 | 304.412 | 7 | ↓ |
| Mid Mid (pH 6-8) | -1.78 | 2.59 | -39.95 | 2 | 6 | 0 | 94 | 304.412 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
