In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 20 | Yes |
Popular Name: (2S)-2-[[(1S)-1-(2-hydroxyphenyl)ethyl]amino]-N,N,4-trimethyl-pentanamide (2S)-2-[[(1S)-1-(2-hydroxyphenyl…
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) | 2.55 | 5.25 | -36.23 | 3 | 4 | 1 | 57 | 279.404 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 4.14 | -8.95 | 2 | 4 | 0 | 53 | 278.396 | 6 | ↓ |