| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 21 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-2-methyl-3-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]propanamide (2S)-2-(cyclopropylamino)-2-meth…
| 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) | 2.09 | 4.08 | -44.03 | 5 | 5 | 1 | 88 | 305.427 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 2.86 | -10.27 | 4 | 5 | 0 | 84 | 304.419 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 4.46 | -94.9 | 6 | 5 | 2 | 90 | 306.435 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
