In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 14 | No |
Popular Name: 6-(pyrrolidin-1-yl)pyridine-3-carbothioamide 6-(pyrrolidin-1-yl)pyridine-3-ca…
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CAS Number: 1016519-59-7
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) | 1.35 | 3.65 | -14.56 | 2 | 3 | 0 | 42 | 207.302 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 3.84 | -48.02 | 3 | 3 | 1 | 43 | 208.31 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 205 - 207 | Enamine Building Blocks |
MP | 205...207 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |