| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 13 | No |
Popular Name: (S)-Methyl-L-thiocitrulline.Dihydrochloride (S)-Methyl-L-thiocitrulline.Dihy…
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CAS Number: 156719-39-0
| 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) | -0.82 | -2.61 | -10.9 | 5 | 5 | 0 | 98 | 205.283 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.82 | -2.3 | -52.52 | 6 | 5 | 1 | 100 | 206.291 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | >98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.