In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2006 | 26 | No |
Popular Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(2-hydroxy-1H-indol-3-yl)imino]butanamide 4-(4-chloro-2-methyl-phenoxy)-N-…
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) | 3.90 | 6.86 | -21.98 | 2 | 6 | 0 | 84 | 371.824 | 6 | ↓ |
Ref Reference (pH 7) | 3.90 | 7 | -14.7 | 2 | 6 | 0 | 84 | 371.824 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.36 | 4.97 | -60.96 | 1 | 6 | -1 | 87 | 370.816 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.36 | 5.24 | -45.95 | 1 | 6 | -1 | 87 | 370.816 | 6 | ↓ |