In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: 4-(4-fluorophenyl)-2-(pyrrolidin-2-yl)-1H-imidazole 4-(4-fluorophenyl)-2-(pyrrolidin…
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CAS Number: 1155056-60-2
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) | 2.01 | 5.94 | -40 | 3 | 3 | 1 | 45 | 232.282 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 4.26 | -5.49 | 2 | 3 | 0 | 41 | 231.274 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 4.28 | -7.11 | 2 | 3 | 0 | 41 | 231.274 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 6.33 | -113.04 | 4 | 3 | 2 | 47 | 233.29 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |