In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 17 | Yes |
Popular Name: (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate (2S,4S)-1-tert-Butyl 2-methyl 4-…
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CAS Number: [121148-01-4]
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) | -1.93 | 3.57 | -80.45 | 3 | 6 | 0 | 97 | 244.291 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.93 | 3.28 | -54.82 | 2 | 6 | -1 | 96 | 243.283 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 7.1 | -49.65 | 4 | 11 | -1 | 163 | 435.505 | 12 | ↓ |