In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 14 | Yes |
Popular Name: (1S,2S)-1-(4-chlorophenyl)-N1,N1-dimethyl-propane-1,2-diamine (1S,2S)-1-(4-chlorophenyl)-N1,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) | 1.81 | 3.9 | -42.23 | 3 | 2 | 1 | 31 | 213.732 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.81 | 5.46 | -116.38 | 4 | 2 | 2 | 32 | 214.74 | 3 | ↓ |