In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 19 | Yes |
Popular Name: 2-methyl-1-[(3S)-quinuclidin-3-yl]benzimidazol-5-amine 2-methyl-1-[(3S)-quinuclidin-3-y…
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) | 1.29 | 5.82 | -48.36 | 3 | 4 | 1 | 48 | 257.361 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 3.39 | -9.22 | 2 | 4 | 0 | 47 | 256.353 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 6.26 | -89.94 | 4 | 4 | 2 | 50 | 258.369 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.