In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2010 | 11 | Yes |
Popular Name: 2-Propen-1-amine, N-methyl-3-(3-pyridinyl)-, (2Z)- (9CI) 2-Propen-1-amine, N-methyl-3-(3-…
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CAS Number: 228271-84-9
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) | 1.03 | 3.69 | -40.95 | 2 | 2 | 1 | 29 | 149.217 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.03 | 4.16 | -88.89 | 3 | 2 | 2 | 31 | 150.225 | 3 | ↓ |