In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 24 | Yes |
Popular Name: (2S)-N-isobutyl-2-[4-[(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]propanamide (2S)-N-isobutyl-2-[4-[(1S)-2-(is…
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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) | 1.35 | 2.32 | -13.64 | 2 | 6 | 0 | 65 | 340.512 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 4.55 | -35.4 | 3 | 6 | 1 | 66 | 341.52 | 8 | ↓ |