In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 21 | Yes |
Popular Name: (2S)-1-[[(1R)-1-(3-bromophenyl)ethyl]amino]-3-(2-isopropoxyethoxy)propan-2-ol (2S)-1-[[(1R)-1-(3-bromophenyl)e…
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) | 2.72 | 5.37 | -45.36 | 3 | 4 | 1 | 55 | 361.3 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 4.27 | -7.31 | 2 | 4 | 0 | 51 | 360.292 | 10 | ↓ |