| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 20 | Yes |
Popular Name: (2S)-2-[(1-benzothien-2-ylcarbonyl)amino]-4-methylpentanoic acid (2S)-2-[(1-benzothien-2-ylcarbon…
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CAS Number: 215941-14-3
| 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) | 1.77 | 8.21 | -55.83 | 1 | 4 | -1 | 69 | 290.364 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 5.22 | -59.77 | 1 | 4 | -1 | 73 | 290.364 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
