In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2009 | 17 | Yes |
Popular Name: 6-[(2-carbamoylethyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid 6-[(2-carbamoylethyl)carbamoyl]c…
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CAS Number: 1153045-18-1
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) | -0.67 | 1.89 | -70.33 | 3 | 6 | -1 | 112 | 239.251 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.67 | -0.07 | -20.71 | 4 | 6 | 0 | 109 | 240.259 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |