In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2005 | 28 | No |
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CAS Number: 301314-58-9
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) | 2.66 | -2.01 | -18.48 | 1 | 9 | 0 | 118 | 422.85 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.66 | -1.52 | -49.15 | 0 | 9 | -1 | 121 | 421.842 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 227 - 229 | Enamine Building Blocks |
MP | 227...229 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |