| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 21 | No |
Popular Name: (3S)-1-(1-ethylpropyl)-3-[[(1R)-2-imidazol-1-yl-1-methyl-ethyl]amino]pyrrolidine-2,5-dione (3S)-1-(1-ethylpropyl)-3-[[(1R)-…
| 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) | 0.65 | 8.03 | -54.23 | 2 | 6 | 1 | 72 | 293.391 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | 6.99 | -11.35 | 1 | 6 | 0 | 67 | 292.383 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 7.5 | -40.88 | 2 | 6 | 1 | 68 | 293.391 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.65 | 8.54 | -116.39 | 3 | 6 | 2 | 73 | 294.399 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
