In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 24 | Yes |
Popular Name: 5-[1-(2-methylbenzyl)-1H-1,3-benzimidazol-2-yl]-2(1H)-pyridinone 5-[1-(2-methylbenzyl)-1H-1,3-ben…
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CAS Number: 860784-66-3
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) | 4.20 | 9.27 | -12.22 | 1 | 4 | 0 | 51 | 315.376 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.20 | 9.25 | -37.98 | 2 | 4 | 1 | 52 | 316.384 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 128 - 130 | KeyOrganics |