In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 28 | Yes |
Popular Name: 4-[(6-chloro-3-ethyl-4-oxo-spiro[1H-quinazoline-2,4'-piperidine]-1'-yl)methyl]benzonitrile 4-[(6-chloro-3-ethyl-4-oxo-spiro…
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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) | 3.24 | 10.64 | -66.62 | 2 | 5 | 1 | 61 | 395.914 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.37 | -13.62 | 1 | 5 | 0 | 59 | 394.906 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.