In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2014 | 13 | Yes |
Popular Name: [(3aS)-5-methoxy-3aH-benzimidazol-2-yl]methanamine [(3aS)-5-methoxy-3aH-benzimidazo…
Find On: PubMed — Wikipedia — Google
CAS Number: 175530-52-6
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) | -1.28 | -1.19 | -7.23 | 2 | 4 | 0 | 60 | 177.207 | 2 | ↓ |
Lo Low (pH 4.5-6) | -1.28 | -0.79 | -41.61 | 3 | 4 | 1 | 62 | 178.215 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.