In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 17 | No |
Popular Name: 5-chloro-N'-hydroxy-2-(1H-1,2,4-triazol-5-ylsulfanyl)benzamidine 5-chloro-N'-hydroxy-2-(1H-1,2,4-…
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) | 0.76 | 2.72 | -9.96 | 4 | 6 | 0 | 100 | 269.717 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.76 | 2.51 | -41.45 | 3 | 6 | -1 | 98 | 268.709 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.