In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 19 | Yes |
Popular Name: (2S)-1-[[(1R)-1-methylpropyl]amino]-3-(2,4,5-trimethylphenoxy)propan-2-ol (2S)-1-[[(1R)-1-methylpropyl]ami…
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) | 3.55 | 6.04 | -36.56 | 3 | 3 | 1 | 46 | 266.405 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.55 | 4.87 | -4.23 | 2 | 3 | 0 | 41 | 265.397 | 7 | ↓ |