In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 18 | Yes |
Popular Name: (2S)-1-[[(1S)-1-(3-fluorophenyl)ethyl]amino]-3-isopropoxy-propan-2-ol (2S)-1-[[(1S)-1-(3-fluorophenyl)…
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) | 2.27 | 4.47 | -45.21 | 3 | 3 | 1 | 46 | 256.341 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 3.39 | -5.09 | 2 | 3 | 0 | 41 | 255.333 | 7 | ↓ |