In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 16 | Yes |
Popular Name: N-(3-aminopropyl)-N-(pyridin-3-ylmethyl)methanesulfonamide dihydrochloride N-(3-aminopropyl)-N-(pyridin-3-y…
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CAS Numbers: 1019389-82-2 , 1172233-43-0
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) | -1.05 | 0.18 | -57.93 | 3 | 5 | 1 | 78 | 244.34 | 6 | ↓ |
Lo Low (pH 4.5-6) | -1.05 | 0.63 | -101.43 | 4 | 5 | 2 | 79 | 245.348 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 167 - 169 | Enamine Building Blocks |
MP | 167...169 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |