In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2011 | 26 | Yes |
Popular Name: (3R)-N-butyl-1-[(2S)-3-[(2-chlorophenyl)methoxy]-2-hydroxy-propyl]piperidine-3-carboxamide (3R)-N-butyl-1-[(2S)-3-[(2-chlor…
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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) | 3.22 | 7.34 | -43.16 | 3 | 5 | 1 | 63 | 383.94 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.22 | 5.07 | -10.83 | 2 | 5 | 0 | 62 | 382.932 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.