In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
Popular Name: {4-[(2-methylpiperidine-1-)sulfonyl]phenyl}methanamine {4-[(2-methylpiperidine-1-)sulfo…
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CAS Number: 953718-55-3
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) | 1.67 | 3.05 | -56.52 | 3 | 4 | 1 | 65 | 269.39 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.67 | 2.66 | -8.61 | 2 | 4 | 0 | 63 | 268.382 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |