In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 29 | No |
Popular Name: N-[5-[(4-bromo-3-chloro-phenyl)methyl]thiazol-2-yl]-7-chloro-1-benzoxepine-4-carboxamide N-[5-[(4-bromo-3-chloro-phenyl)m…
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) | 7.04 | 12.72 | -17.58 | 1 | 4 | 0 | 55 | 508.224 | 4 | ↓ |
Hi High (pH 8-9.5) | 7.11 | 11.31 | -48.97 | 0 | 4 | -1 | 61 | 507.216 | 4 | ↓ |