In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 22 | Yes |
Popular Name: 2-(2-cyclohexylbenzimidazol-1-yl)-N,N-diethyl-ethanamine 2-(2-cyclohexylbenzimidazol-1-yl…
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) | 4.27 | 12.13 | -47.11 | 1 | 3 | 1 | 22 | 300.47 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 9.97 | -6.52 | 0 | 3 | 0 | 21 | 299.462 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.27 | 12.58 | -91.81 | 2 | 3 | 2 | 24 | 301.478 | 6 | ↓ |