In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2011 | 28 | No |
Popular Name: N-[3-(isopropylcarbamoyl)-4-methyl-phenyl]-N'-[2-[(3S)-3-methyl-1-piperidyl]ethyl]oxamide N-[3-(isopropylcarbamoyl)-4-meth…
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) | 1.64 | 6.23 | -46.84 | 4 | 7 | 1 | 92 | 389.52 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 5.43 | -60.7 | 3 | 7 | 0 | 98 | 388.512 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.