In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 18 | Yes |
Popular Name: (5S,6S)-5-amino-1-tert-butyl-6-(1-methylpyrazol-4-yl)piperidin-2-one (5S,6S)-5-amino-1-tert-butyl-6-(…
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) | 0.07 | 2.72 | -49.82 | 3 | 5 | 1 | 66 | 251.354 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.07 | 2.4 | -9.85 | 2 | 5 | 0 | 64 | 250.346 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.