| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2008 | 21 | Yes |
Popular Name: (1S,2S)-N-Methanesulfonyl-1,2-diphenylethanediamine (1S,2S)-N-Methanesulfonyl-1,2-di…
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CAS Number: 300345-76-0
(1S,2S)-N-Methylsulfonyl-1,2-diphenylethanediamine
| 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) | 0.13 | 3.19 | -63.87 | 4 | 5 | 1 | 83 | 307.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 3.04 | -39.7 | 2 | 5 | -1 | 83 | 305.379 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 2.71 | -11.14 | 3 | 5 | 0 | 81 | 306.387 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 118-120? | Alfa-Aesar |
| Melting_Point | 118-120° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.