| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 19 | Yes |
Popular Name: 1-[3-(aminomethyl)phenyl]-3-[(1S)-1-cyclopentylethyl]urea 1-[3-(aminomethyl)phenyl]-3-[(1S…
| 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) | 2.72 | 4.52 | -53.94 | 5 | 4 | 1 | 69 | 262.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 4.12 | -8.77 | 4 | 4 | 0 | 67 | 261.369 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
