In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2014 | 14 | Yes |
Popular Name: 1H-Benzimidazol-4-ol, 2-(methoxymethyl)-1-methyl- (9CI) 1H-Benzimidazol-4-ol, 2-(methoxy…
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CAS Number: 177478-24-9
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) | 1.29 | 1.75 | -12.86 | 1 | 4 | 0 | 47 | 192.218 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 2.51 | -59.56 | 0 | 4 | -1 | 50 | 191.21 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 3.2 | -33.92 | 1 | 4 | 0 | 51 | 192.218 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.