| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 18 | No |
Popular Name: (3S)-3-[[(1R)-1-cyclopentylethyl]amino]-1-propyl-pyrrolidine-2,5-dione (3S)-3-[[(1R)-1-cyclopentylethyl…
| 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) | 1.88 | 6.24 | -47.14 | 2 | 4 | 1 | 54 | 253.366 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 5.22 | -7.49 | 1 | 4 | 0 | 49 | 252.358 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 5.25 | -5.93 | 1 | 4 | 0 | 49 | 252.358 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
