In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 23 | Yes |
Popular Name: 1-(2-diethylaminoethyl)-2-(3-hydroxypropyl)benzimidazole-5-carboxylic 1-(2-diethylaminoethyl)-2-(3-hyd…
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) | 2.09 | 7.79 | -91.17 | 2 | 6 | 0 | 83 | 319.405 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 5.66 | -57.31 | 1 | 6 | -1 | 81 | 318.397 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.09 | 8.08 | -113.79 | 3 | 6 | 1 | 84 | 320.413 | 9 | ↓ |