In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2011 | 27 | No |
Popular Name: N-[4-(isopropylcarbamoyl)-3-methyl-phenyl]-N'-[2-(1-piperidyl)ethyl]oxamide N-[4-(isopropylcarbamoyl)-3-meth…
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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) | 1.40 | 5.66 | -46.29 | 4 | 7 | 1 | 92 | 375.493 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 4.84 | -58.92 | 3 | 7 | 0 | 98 | 374.485 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.