| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 21 | Yes |
Popular Name: 1-(3-cyanophenyl)-3-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]urea 1-(3-cyanophenyl)-3-[(3S)-1-(2-m…
| 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) | 1.31 | 5.21 | -47.55 | 3 | 6 | 1 | 79 | 289.359 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 2.64 | -14.21 | 2 | 6 | 0 | 77 | 288.351 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
