| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 19 | No |
Popular Name: (S)-2-Amino-3,N-dimethyl-N-(3-nitro-benzyl)-butyramide (S)-2-Amino-3,N-dimethyl-N-(3-ni…
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CAS Number: 1308958-34-0
| 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) | 0.98 | 5.79 | -47.64 | 3 | 6 | 1 | 94 | 266.321 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 5.52 | -7.87 | 2 | 6 | 0 | 92 | 265.313 | 5 | ↓ |
