In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 24th, 2008 | 30 | No |
Popular Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-4-chloro-3-nitro-benzamide N-[4-[4-(2-acetamidoethyl)phenyl…
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) | 3.45 | 9.48 | -22.55 | 2 | 8 | 0 | 117 | 444.9 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 7.43 | -47.31 | 1 | 8 | -1 | 123 | 443.892 | 7 | ↓ |