In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 28 | Yes |
Popular Name: (1S)-1-(2-chloro-6-fluoro-phenyl)-2-(2-pyridylmethyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole (1S)-1-(2-chloro-6-fluoro-phenyl…
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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) | 4.92 | 13.18 | -27.08 | 2 | 3 | 1 | 33 | 392.885 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.92 | 13.39 | -97.88 | 3 | 3 | 2 | 34 | 393.893 | 3 | ↓ |