In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 18 | Yes |
Popular Name: (1S)-N-[2-(2,4-dichlorophenyl)ethyl]-1-(2-thienyl)ethanamine (1S)-N-[2-(2,4-dichlorophenyl)et…
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) | 5.04 | 8.32 | -3.24 | 1 | 1 | 0 | 12 | 300.254 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.04 | 9.63 | -41.57 | 2 | 1 | 1 | 17 | 301.262 | 5 | ↓ |