In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2S)-1-(5-chloro-2-thienyl)-2-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]propan-1-one (2S)-1-(5-chloro-2-thienyl)-2-[m…
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) | 2.90 | 7.69 | -34.81 | 1 | 3 | 1 | 31 | 288.82 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 5.37 | -7.15 | 0 | 3 | 0 | 30 | 287.812 | 5 | ↓ |