In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: N,N-diethyl-N'-[(1R)-3-(4-methoxyphenyl)-1-methyl-propyl]ethane-1,2-diamine N,N-diethyl-N'-[(1R)-3-(4-methox…
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) | 3.59 | 7.17 | -42.55 | 2 | 3 | 1 | 29 | 279.448 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 8.15 | -34.92 | 2 | 3 | 1 | 26 | 279.448 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 9.32 | -117.53 | 3 | 3 | 2 | 30 | 280.456 | 10 | ↓ |