In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (1R)-1-(1,3-benzothiazol-2-yl)-N-(2-phenylsulfanylethyl)ethanamine (1R)-1-(1,3-benzothiazol-2-yl)-N…
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) | 4.28 | 9.47 | -42.57 | 2 | 2 | 1 | 29 | 315.487 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 8.3 | -7.83 | 1 | 2 | 0 | 25 | 314.479 | 6 | ↓ |