| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 18 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-(4-methyl-1,4-diazepan-1-yl)propanamide (2S)-2-cyclopropyl-2-(methylamin…
| 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) | -0.05 | 3.2 | -104.05 | 5 | 5 | 2 | 67 | 256.394 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 2.07 | -35.39 | 4 | 5 | 1 | 63 | 255.386 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | -1.01 | -6.52 | 3 | 5 | 0 | 62 | 254.378 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 1.57 | -39.45 | 4 | 5 | 1 | 63 | 255.386 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
