In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: N,N-diethyl-N'-[(1S)-1-methyl-3-phenyl-propyl]ethane-1,2-diamine N,N-diethyl-N'-[(1S)-1-methyl-3-…
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) | 3.53 | 8.07 | -41.02 | 2 | 2 | 1 | 20 | 249.422 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 10.27 | -116.91 | 3 | 2 | 2 | 21 | 250.43 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 8.98 | -32.72 | 2 | 2 | 1 | 16 | 249.422 | 9 | ↓ |