In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 8th, 2011 | 23 | Yes |
Popular Name: 4-amino-3-(3-methoxyphenyl)-N-(2-thienylmethyl)isothiazole-5-carboxamide 4-amino-3-(3-methoxyphenyl)-N-(2…
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) | 2.91 | 4.34 | -8.64 | 3 | 5 | 0 | 77 | 345.449 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.