| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 14th, 2014 | 21 | Yes |
Popular Name: (R)-4-(1-Aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzamidedihydrochloride (R)-4-(1-Aminoethyl)-N-(1H-pyrro…
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CAS Number: 173897-44-4
| 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) | -0.06 | 4.58 | -57.74 | 5 | 5 | 1 | 85 | 281.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | 4.25 | -12.8 | 4 | 5 | 0 | 84 | 280.331 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.