In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | Yes |
Popular Name: (1S)-N'-ethyl-N'-[(1S)-2-methoxy-1-methyl-ethyl]-1-phenyl-ethane-1,2-diamine (1S)-N'-ethyl-N'-[(1S)-2-methoxy…
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) | 0.15 | 4.44 | -41 | 3 | 3 | 1 | 40 | 237.367 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.15 | 3.43 | -2.91 | 2 | 3 | 0 | 38 | 236.359 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.15 | 5.71 | -116.65 | 4 | 3 | 2 | 41 | 238.375 | 7 | ↓ |