| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 17 | Yes |
Popular Name: N-[(1S)-1-cyclopropyl-2-(4-methyl-1,4-diazepan-1-yl)ethyl]propan-1-amine N-[(1S)-1-cyclopropyl-2-(4-methy…
| 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) | 2.02 | 7.56 | -85.56 | 3 | 3 | 2 | 24 | 241.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 7.16 | -33.24 | 2 | 3 | 1 | 23 | 240.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
