In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 21 | Yes |
Popular Name: (1S)-N'-(1,3-benzothiazol-2-yl)-N,N-dimethyl-1-phenyl-ethane-1,2-diamine (1S)-N'-(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) | 3.96 | 9.92 | -42.5 | 2 | 3 | 1 | 29 | 298.435 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.96 | 7.32 | -6.42 | 1 | 3 | 0 | 28 | 297.427 | 5 | ↓ |