In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 21 | Yes |
Popular Name: 4-[[methyl-[2-oxo-2-(thiazol-2-ylamino)ethyl]amino]methyl]benzoic 4-[[methyl-[2-oxo-2-(thiazol-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) | 1.88 | 7.64 | -90.37 | 2 | 6 | 0 | 87 | 305.359 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 7 | -84.61 | 1 | 6 | -1 | 93 | 304.351 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.