| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 26 | Yes |
Popular Name: (2S,3R)-N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-3-methyl-2-ureido-pentanamide (2S,3R)-N-[[6-(azepan-1-yl)-3-py…
| 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) | 2.11 | 5.31 | -39.28 | 5 | 7 | 1 | 102 | 362.498 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 4.99 | -13 | 4 | 7 | 0 | 100 | 361.49 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
