In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 27 | No |
Popular Name: 1-BOC-4-[4-(Methylsulfonyl)-2-nitrophenyl]-piperidin-4-amine 1-BOC-4-[4-(Methylsulfonyl)-2-ni…
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CAS Number: 849035-91-2
1-Boc-4-[4-(methylsulfonyl)-2-nitrophenyl]piperidin-4-amine
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) | 1.60 | 4.25 | -21.12 | 2 | 9 | 0 | 136 | 399.469 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 157-158° | Matrix Scientific |
Warnings | Irritant | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.