In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 19 | No |
Popular Name: 2-chloro-6-[(6-methyl-2-pyridyl)methylamino]benzenecarbothioamide 2-chloro-6-[(6-methyl-2-pyridyl)…
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) | 2.46 | 5.55 | -12.41 | 3 | 3 | 0 | 51 | 291.807 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 5.93 | -40.75 | 4 | 3 | 1 | 52 | 292.815 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.