| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 32 | No |
Popular Name: (3S)-1-[4-[[[2-(dioxoBLAHyl)acetyl]amino]methyl]phenyl]piperidine-3-carboxamide (3S)-1-[4-[[[2-(dioxoBLAHyl)acet…
| 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) | 1.45 | 5.8 | -20.28 | 3 | 8 | 0 | 113 | 436.512 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 6.43 | -50.2 | 4 | 8 | 1 | 114 | 437.52 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
