In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: [2-(2-Ethyl-1-piperidinyl)-3-pyridinyl]methanamine [2-(2-Ethyl-1-piperidinyl)-3-pyr…
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CAS Numbers: 1095019-40-1 , N/A
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) | 2.05 | 5.04 | -48.11 | 3 | 3 | 1 | 44 | 220.34 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 4.77 | -4.34 | 2 | 3 | 0 | 42 | 219.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.05 | 5.51 | -100.62 | 4 | 3 | 2 | 45 | 221.348 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |