In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 21 | Yes |
Popular Name: (1S)-1-(2,4-dichlorophenyl)-N-methyl-N-[2-(4-pyridyl)ethyl]ethane-1,2-diamine (1S)-1-(2,4-dichlorophenyl)-N-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) | 2.53 | 6.85 | -50.23 | 3 | 3 | 1 | 44 | 325.263 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 6.44 | -100.96 | 4 | 3 | 2 | 45 | 326.271 | 6 | ↓ |