In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 11th, 2008 | 27 | No |
Popular Name: (3Z,4S)-3-[(1-benzyl-4-piperidyl)imino]-4-(4-chlorophenyl)cyclobutane-1,2-dione (3Z,4S)-3-[(1-benzyl-4-piperidyl…
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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) | 3.01 | 10.82 | -48.15 | 1 | 4 | 0 | 51 | 381.883 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 8.59 | -7.47 | 0 | 4 | 0 | 50 | 380.875 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 8.56 | -9.26 | 0 | 4 | 0 | 50 | 380.875 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 10.79 | -59.53 | 1 | 4 | 0 | 51 | 381.883 | 4 | ↓ |