In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 21 | Yes |
Popular Name: (1S)-N-[(5-chloro-2-methoxy-phenyl)methyl]-1-(4-methylsulfanylphenyl)ethanamine (1S)-N-[(5-chloro-2-methoxy-phen…
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) | 4.55 | 9.77 | -40.78 | 2 | 2 | 1 | 26 | 322.881 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 8.64 | -4.5 | 1 | 2 | 0 | 21 | 321.873 | 6 | ↓ |