In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 15 | Yes |
Popular Name: N-(2-diethylaminoethyl)-N',N'-dimethyl-butane-1,4-diamine N-(2-diethylaminoethyl)-N',N'-di…
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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) | 1.10 | 5.64 | -92.15 | 3 | 3 | 2 | 24 | 217.401 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.10 | 4.26 | -32.87 | 2 | 3 | 1 | 20 | 216.393 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 7.76 | -175.85 | 4 | 3 | 3 | 25 | 218.409 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 6.38 | -74.75 | 3 | 3 | 2 | 21 | 217.401 | 10 | ↓ |