In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 19 | Yes |
Popular Name: 4-phenyl-5-(propan-2-yl)-2-(pyrrolidin-2-yl)-1H-imidazole 4-phenyl-5-(propan-2-yl)-2-(pyrr…
Find On: PubMed — Wikipedia — Google
CAS Number: 1153105-13-5
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) | 3.13 | 7.54 | -36.85 | 3 | 3 | 1 | 45 | 256.373 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 5.93 | -4.75 | 2 | 3 | 0 | 41 | 255.365 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 5.88 | -6.31 | 2 | 3 | 0 | 41 | 255.365 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.13 | 8 | -103.72 | 4 | 3 | 2 | 47 | 257.381 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |