In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 21 | Yes |
Popular Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]propanoic acid 3-[4-(azepan-1-ylsulfonyl)phenyl…
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CAS Number: 793678-96-3
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) | 2.61 | -3.44 | -49.56 | 0 | 5 | -1 | 77 | 310.395 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 122 - 124 | Enamine Building Blocks |
MP | 122...124 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |