In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 19 | No |
Popular Name: 3-chloro-5-[(4-nitrophenyl)methylamino]isothiazole-4-carbonitrile 3-chloro-5-[(4-nitrophenyl)methy…
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) | 2.89 | 6.31 | -15.01 | 1 | 6 | 0 | 95 | 294.723 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.