In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2011 | 26 | Yes |
Popular Name: N-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-4-(4-pyridylmethyl)piperazine-1-carboxamide N-[(1S)-1-(3-chloro-4-fluoro-phe…
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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) | 3.27 | 7.27 | -11.63 | 1 | 5 | 0 | 48 | 376.863 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.27 | 9.48 | -57.59 | 2 | 5 | 1 | 50 | 377.871 | 4 | ↓ |