In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 32 | No |
Popular Name: N-(4-acetamidophenyl)-N'-[(2R)-2-(1H-indol-3-yl)-2-pyrrolidin-1-yl-ethyl]oxamide N-(4-acetamidophenyl)-N'-[(2R)-2…
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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) | 1.61 | 7.1 | -46.7 | 5 | 8 | 1 | 108 | 434.52 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 5.49 | -15.76 | 4 | 8 | 0 | 106 | 433.512 | 7 | ↓ |