In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 17 | Yes |
Popular Name: N-[(4-tert-butylphenyl)methyl]-N,N'-dimethyl-ethane-1,2-diamine N-[(4-tert-butylphenyl)methyl]-N…
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) | 3.23 | 6.28 | -37.77 | 2 | 2 | 1 | 20 | 235.395 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 7.16 | -34.49 | 2 | 2 | 1 | 16 | 235.395 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 8.6 | -112.27 | 3 | 2 | 2 | 21 | 236.403 | 6 | ↓ |