| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 18 | No |
Popular Name: 1H-Indole-3-carboxaldehyde, 5-methyl-2-(4-pyridinyl)- (9CI) 1H-Indole-3-carboxaldehyde, 5-me…
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CAS Number: 590349-05-6
| 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) | 2.69 | 6.69 | -8.25 | 1 | 3 | 0 | 46 | 236.274 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.69 | 7.15 | -36.57 | 2 | 3 | 1 | 47 | 237.282 | 2 | ↓ |
