In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 16 | Yes |
Popular Name: Methyl 6-(pyrrolidin-1-ylmethyl)picolinate Methyl 6-(pyrrolidin-1-ylmethyl)…
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CAS Number: 125104-87-2
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) | 0.88 | 6.56 | -40.45 | 1 | 4 | 1 | 44 | 221.28 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 4.05 | -7.63 | 0 | 4 | 0 | 42 | 220.272 | 4 | ↓ |