In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-N1-[(1S)-2-methoxy-1-methyl-ethyl]-N1-methyl-propane-1,2-diamine (1S,2R)-1-(4-chlorophenyl)-N1-[(…
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) | 2.12 | 3.35 | -46.05 | 3 | 3 | 1 | 40 | 271.812 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 5.63 | -110.4 | 4 | 3 | 2 | 41 | 272.82 | 6 | ↓ |