In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 31 | No |
Popular Name: 7-chloro-N-[4-methyl-5-[(3-nitrophenyl)methyl]thiazol-2-yl]-1-benzoxepine-4-carboxamide 7-chloro-N-[4-methyl-5-[(3-nitro…
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) | 5.78 | 12.85 | -20.52 | 1 | 7 | 0 | 101 | 453.907 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.85 | 11.44 | -54.27 | 0 | 7 | -1 | 107 | 452.899 | 5 | ↓ |