In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-1-(4-ethylphenoxy)-3-[[(2R)-2-hydroxypropyl]amino]propan-2-ol (2S)-1-(4-ethylphenoxy)-3-[[(2R)…
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) | 1.43 | 1.62 | -41.65 | 4 | 4 | 1 | 66 | 254.35 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 0.21 | -7.25 | 3 | 4 | 0 | 62 | 253.342 | 8 | ↓ |