In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 21 | Yes |
Popular Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-7-methyl-octan-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) | 5.66 | 10.43 | -37.77 | 2 | 2 | 1 | 29 | 305.511 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.66 | 9.21 | -5.78 | 1 | 2 | 0 | 25 | 304.503 | 9 | ↓ |