In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-N',N'-dimethyl-butane-1,4-diamine N-[(1R)-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) | 2.79 | 8.11 | -94.51 | 3 | 3 | 2 | 34 | 279.453 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 6.92 | -38.36 | 2 | 3 | 1 | 29 | 278.445 | 7 | ↓ |