In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | Yes |
Popular Name: 1-(5-bromo-1,3-benzothiazol-2-yl)-N-(cyclopropylmethyl)methanamine 1-(5-bromo-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) | 3.32 | 6.94 | -43.11 | 2 | 2 | 1 | 29 | 298.229 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 5.58 | -4.58 | 1 | 2 | 0 | 25 | 297.221 | 4 | ↓ |