In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 16 | Yes |
Popular Name: (2S)-N-butyl-2-[(3S)-3-methyl-1-piperidyl]propanamide (2S)-N-butyl-2-[(3S)-3-methyl-1-…
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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) | 2.37 | 6.4 | -32.85 | 2 | 3 | 1 | 34 | 227.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 4.21 | -7.15 | 1 | 3 | 0 | 32 | 226.364 | 5 | ↓ |