In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-ethyl-N-[(1S)-1-(4-methylthiazol-5-yl)ethyl]hexan-1-amine (2S)-2-ethyl-N-[(1S)-1-(4-methyl…
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) | 4.64 | 7.82 | -41.25 | 2 | 2 | 1 | 29 | 255.451 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.64 | 6.64 | -3.97 | 1 | 2 | 0 | 25 | 254.443 | 8 | ↓ |