In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 19 | Yes |
Popular Name: N'-[(4-tert-butylphenyl)methyl]-N,N'-diethyl-ethane-1,2-diamine N'-[(4-tert-butylphenyl)methyl]-…
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) | 3.63 | 8.07 | -36.04 | 2 | 2 | 1 | 20 | 263.449 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 8.79 | -33.41 | 2 | 2 | 1 | 16 | 263.449 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.63 | 10.15 | -109.75 | 3 | 2 | 2 | 21 | 264.457 | 8 | ↓ |