In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2010 | 14 | Yes |
Popular Name: Methyl-(1-pyrrolidin-1-ylmethyl-cyclohexyl)-amine Methyl-(1-pyrrolidin-1-ylmethyl-…
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CAS Number: 675602-55-8
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) | 2.51 | 7.06 | -105.53 | 3 | 2 | 2 | 21 | 198.354 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 5.18 | -31.33 | 2 | 2 | 1 | 20 | 197.346 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 6.54 | -28.55 | 2 | 2 | 1 | 16 | 197.346 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 97% | Fluorochem |