| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 1st, 2013 | 17 | Yes |
Popular Name: (S)-t-Butyl-decahydro-3-isoquinoline carboxamide (S)-t-Butyl-decahydro-3-isoquino…
Find On: PubMed — Wikipedia — Google
CAS Number: 136465-81-1
| 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) | 3.35 | 1.75 | -38.21 | 4 | 3 | 1 | 60 | 239.383 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | -0.93 | -4.22 | 3 | 3 | 0 | 55 | 238.375 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.