In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 10th, 2004 | 30 | No |
Popular Name: N-[4-(1,3-benzothiazol-2-yl)-3-hydroxy-phenyl]-4-methoxy-3-nitro-benzamide N-[4-(1,3-benzothiazol-2-yl)-3-h…
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) | 4.83 | 8.1 | -24.18 | 2 | 8 | 0 | 117 | 421.434 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.90 | 6.41 | -50.09 | 1 | 8 | -1 | 124 | 420.426 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.83 | 8.72 | -55.56 | 1 | 8 | -1 | 120 | 420.426 | 5 | ↓ |