| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: 1-[(3S)-3-aminopyrrolidin-1-yl]-3-(azocan-1-yl)propan-1-one 1-[(3S)-3-aminopyrrolidin-1-yl]-…
| 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) | 0.88 | 5.33 | -94.3 | 4 | 4 | 2 | 52 | 255.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 5.04 | -37.71 | 3 | 4 | 1 | 51 | 254.398 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
