In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 16 | Yes |
Popular Name: [2-chloro-6-(4-methylthiazol-2-yl)sulfanyl-phenyl]methanamine [2-chloro-6-(4-methylthiazol-2-y…
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) | 3.11 | 4.62 | -38.68 | 3 | 2 | 1 | 41 | 271.818 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 4.22 | -6.97 | 2 | 2 | 0 | 39 | 270.81 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.