| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 8th, 2011 | 25 | No |
Popular Name: 5-phenyl-N-[(5S)-3-phenyl-4,5-dihydro-1,2,4-thiadiazol-5-yl]-4H-pyrazole-3-carboxamide 5-phenyl-N-[(5S)-3-phenyl-4,5-di…
| 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) | 1.95 | 6.59 | -33.41 | 3 | 6 | 1 | 80 | 350.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 6.52 | -13.91 | 2 | 6 | 0 | 78 | 349.419 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 6.4 | -33.03 | 3 | 6 | 1 | 80 | 350.427 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 4.19 | -34.21 | 2 | 6 | 0 | 86 | 349.419 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
