| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 25 | Yes |
Popular Name: 1-[2-(azepan-1-yl)phenyl]-3-[3-(methanesulfonamido)propyl]urea 1-[2-(azepan-1-yl)phenyl]-3-[3-(…
| 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) | 2.34 | 4.14 | -16.92 | 3 | 7 | 0 | 91 | 368.503 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 3.81 | -47.19 | 4 | 7 | 1 | 92 | 369.511 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
