In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 19 | Yes |
Popular Name: 3-pyridinemethanamine, N-[2-(4-ethylphenoxy)ethyl]- 3-pyridinemethanamine, N-[2-(4-e…
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CAS Number: 866155-29-5
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) | 2.86 | 7.61 | -46.08 | 2 | 3 | 1 | 39 | 257.357 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | 7.89 | -104.4 | 3 | 3 | 2 | 40 | 258.365 | 7 | ↓ |