| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 25 | No |
Popular Name: 3-[3-[4-(dimethylamino)-1-piperidyl]-3-oxo-propyl]-2-thioxo-1H-quinazolin-4-one 3-[3-[4-(dimethylamino)-1-piperi…
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| 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) | 1.08 | 9.49 | -48.59 | 2 | 6 | 1 | 63 | 361.491 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 9.18 | -65.26 | 1 | 6 | 0 | 60 | 360.483 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
