In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(p-tolyl)ethyl]-(1-ethylpropyl)amino]ethanol 2-[[(1R)-2-amino-1-(p-tolyl)ethy…
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) | 2.29 | 4.88 | -108.94 | 5 | 3 | 2 | 52 | 266.429 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 3.91 | -40.7 | 4 | 3 | 1 | 51 | 265.421 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 4.75 | -24.56 | 4 | 3 | 1 | 51 | 265.421 | 8 | ↓ |