In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 17 | Yes |
Popular Name: (1S)-1-phenyl-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethanol (1S)-1-phenyl-2-[[(1S)-1-(2-thie…
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) | 2.77 | 4.29 | -4.47 | 2 | 2 | 0 | 32 | 247.363 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 5.55 | -39.65 | 3 | 2 | 1 | 37 | 248.371 | 5 | ↓ |