| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 19 | Yes |
Popular Name: (2S)-N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-2-imidazol-1-yl-propanamide (2S)-N-(5-tert-butyl-1,3,4-thiad…
| 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) | 1.32 | 6.39 | -22.29 | 1 | 6 | 0 | 73 | 279.369 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 5.15 | -46.79 | 0 | 6 | -1 | 79 | 278.361 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 7.22 | -45.01 | 2 | 6 | 1 | 74 | 280.377 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
