In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 24 | Yes |
Popular Name: 1-(4-chlorobenzyl)-2-(2-chloro-3-pyridinyl)-1H-1,3-benzimidazole 1-(4-chlorobenzyl)-2-(2-chloro-3…
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CAS Number: 338411-33-9
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) | 5.62 | 11.44 | -14.48 | 0 | 3 | 0 | 31 | 354.24 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.62 | 11.86 | -31.42 | 1 | 3 | 1 | 32 | 355.248 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 125 - 126 | KeyOrganics |