In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 16 | Yes |
Popular Name: (1S,2S)-1-(5-chloro-2-thienyl)-2-ethyl-N-methyl-hexan-1-amine (1S,2S)-1-(5-chloro-2-thienyl)-2…
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) | 5.57 | 8.61 | -39.75 | 2 | 1 | 1 | 17 | 260.854 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.57 | 7.67 | -0.91 | 1 | 1 | 0 | 12 | 259.846 | 7 | ↓ |