In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2013 | 22 | Yes |
Popular Name: 4-(6-Bromo-pyridin-2-ylsulfanylmethyl)-piperidine-1-carboxylic acid tert-butyl ester 4-(6-Bromo-pyridin-2-ylsulfanylm…
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CAS Number: 1353951-64-0
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) | 4.62 | 9.2 | -8.75 | 0 | 4 | 0 | 42 | 387.343 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.