| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | Yes |
Popular Name: (3S)-3-methyl-1-quinazolin-4-yl-piperidine-3-carboxylic (3S)-3-methyl-1-quinazolin-4-yl-…
| 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) | 2.03 | 9.57 | -48.94 | 0 | 5 | -1 | 69 | 270.312 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 10.03 | -58.52 | 1 | 5 | 0 | 70 | 271.32 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 10.07 | -50.25 | 1 | 5 | 0 | 70 | 271.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
