| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2014 | 14 | Yes |
Popular Name: 1H-Benzimidazol-5-amine, 4-butyl- (9CI) 1H-Benzimidazol-5-amine, 4-butyl…
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CAS Number: 177843-34-4
| 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) | 2.68 | 5.1 | -8.18 | 3 | 3 | 0 | 55 | 189.262 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 5.07 | -8.71 | 3 | 3 | 0 | 55 | 189.262 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.68 | 5.58 | -32.49 | 4 | 3 | 1 | 56 | 190.27 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.