In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: (1S)-N'-[(2-methoxyphenyl)methyl]-N,N'-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-[(2-methoxyphenyl)methyl…
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) | 3.12 | 7.75 | -33.69 | 2 | 3 | 1 | 29 | 285.411 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 5.89 | -3.72 | 1 | 3 | 0 | 24 | 284.403 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | 9.68 | -114.2 | 3 | 3 | 2 | 30 | 286.419 | 7 | ↓ |