In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 21 | Yes |
Popular Name: N-[(S)-(7-bromo-1,3-benzodioxol-5-yl)-(4-methylthiazol-2-yl)methyl]propan-2-amine N-[(S)-(7-bromo-1,3-benzodioxol-…
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) | 3.46 | 6.38 | -39.13 | 2 | 4 | 1 | 48 | 370.292 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 5.48 | -6.66 | 1 | 4 | 0 | 43 | 369.284 | 4 | ↓ |