In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 4-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-4-oxo-butanoic 4-[[(1R)-1-(3-hydroxyphenyl)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) | 0.66 | 2.99 | -47.63 | 2 | 5 | -1 | 89 | 236.247 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.66 | 1.01 | -10.61 | 3 | 5 | 0 | 87 | 237.255 | 5 | ↓ |