In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: N,N-diethyl-N'-[(1R)-2-(2-methoxyphenyl)-1-methyl-ethyl]ethane-1,2-diamine N,N-diethyl-N'-[(1R)-2-(2-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) | 3.02 | 6.98 | -30.71 | 2 | 3 | 1 | 29 | 265.421 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 5.28 | -3.24 | 1 | 3 | 0 | 24 | 264.413 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 9.07 | -101.28 | 3 | 3 | 2 | 30 | 266.429 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 7.38 | -31.16 | 2 | 3 | 1 | 26 | 265.421 | 9 | ↓ |