| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 25 | No |
Popular Name: 3-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-thioxo-1H-quinazolin-4-one 3-[3-[5-methyl-3-(trifluoromethy…
| 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) | 2.74 | 9.45 | -16.7 | 1 | 5 | 0 | 56 | 368.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 9.03 | -43.56 | 0 | 5 | -1 | 53 | 367.376 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
