In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 21 | Yes |
Popular Name: 1-(difluoromethyl)-2-[(4-ethylpiperazin-1-yl)methyl]benzimidazole 1-(difluoromethyl)-2-[(4-ethylpi…
None
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) | 2.23 | 6.85 | -39.02 | 1 | 4 | 1 | 26 | 295.357 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 4.59 | -6.89 | 0 | 4 | 0 | 24 | 294.349 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.23 | 7.21 | -83.85 | 2 | 4 | 2 | 27 | 296.365 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.