In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: (1R)-1-(4-tert-butylphenyl)-N-methyl-N-propyl-ethane-1,2-diamine (1R)-1-(4-tert-butylphenyl)-N-me…
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) | 3.31 | 8.24 | -123.38 | 4 | 2 | 2 | 32 | 250.43 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 6.26 | -45.46 | 3 | 2 | 1 | 31 | 249.422 | 6 | ↓ |