In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 21 | Yes |
Popular Name: 2-ethyl-1-[(1S)-1-methyl-2-(1-piperidyl)ethyl]benzimidazol-5-amine 2-ethyl-1-[(1S)-1-methyl-2-(1-pi…
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) | 2.51 | 8.5 | -46.78 | 3 | 4 | 1 | 48 | 287.431 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 6.54 | -8.12 | 2 | 4 | 0 | 47 | 286.423 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.51 | 8.93 | -89.1 | 4 | 4 | 2 | 50 | 288.439 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.