| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(isopropylamino)-3-(4-methyl-1,4-diazepan-1-yl)propanamide (2S)-2-cyclopropyl-2-(isopropyla…
| 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) | 0.62 | 3.99 | -87.5 | 5 | 5 | 2 | 67 | 284.448 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.62 | 1.98 | -37.55 | 4 | 5 | 1 | 66 | 283.44 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.62 | 2.17 | -4.71 | 3 | 5 | 0 | 62 | 282.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
