In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | Yes |
Popular Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]hexan-1-amine N-[(1S)-1-(1,3-benzothiazol-2-yl…
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) | 4.67 | 8.45 | -38.84 | 2 | 2 | 1 | 29 | 263.43 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.67 | 7.17 | -6.16 | 1 | 2 | 0 | 25 | 262.422 | 7 | ↓ |