In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 22 | Yes |
Popular Name: N-[5-[(4-chlorophenyl)methyl]-4-methyl-thiazol-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide N-[5-[(4-chlorophenyl)methyl]-4-…
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) | 2.84 | 6.36 | -40.26 | 3 | 5 | 1 | 68 | 335.84 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.3 | -11.58 | 2 | 5 | 0 | 66 | 334.832 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 4.64 | -30.22 | 2 | 5 | 0 | 74 | 334.832 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 3.52 | -47.49 | 1 | 5 | -1 | 73 | 333.824 | 4 | ↓ |