In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-N1-methyl-N1-(4-pyridylmethyl)propane-1,2-diamine (1S,2R)-1-(4-chlorophenyl)-N1-me…
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) | 1.92 | 5.9 | -49.27 | 3 | 3 | 1 | 44 | 290.818 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 7.6 | -139.26 | 4 | 3 | 2 | 45 | 291.826 | 5 | ↓ |