In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 28 | No |
Popular Name: N'-[2-[(2S)-2-methyl-1-piperidyl]ethyl]-N-[4-[[(1S)-1-methylpropyl]carbamoyl]phenyl]oxamide N'-[2-[(2S)-2-methyl-1-piperidyl…
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) | 1.89 | 6.4 | -44.76 | 4 | 7 | 1 | 92 | 389.52 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.08 | 5.61 | -62.58 | 3 | 7 | 0 | 98 | 388.512 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.