| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(ethylamino)-3-(4-methyl-1,4-diazepan-1-yl)propanamide (2S)-2-cyclopropyl-2-(ethylamino…
| 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) | 0.32 | 3.77 | -100.83 | 5 | 5 | 2 | 67 | 270.421 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 2.89 | -35.32 | 4 | 5 | 1 | 63 | 269.413 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 1.03 | -5.3 | 3 | 5 | 0 | 62 | 268.405 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
