In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | No |
Popular Name: 3,4-dichloro-5-nitro-N-(1,3,4-thiadiazol-2-yl)benzamide 3,4-dichloro-5-nitro-N-(1,3,4-th…
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) | 2.72 | 5.71 | -17.31 | 1 | 7 | 0 | 101 | 319.129 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.78 | 4.05 | -38.41 | 0 | 7 | -1 | 107 | 318.121 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.