In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 17 | No |
Popular Name: 4-(chloromethyl)-2-[2-(4-methyl-1,4-diazepan-1-yl)ethyl]thiazole 4-(chloromethyl)-2-[2-(4-methyl-…
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) | 1.79 | 6.13 | -35.95 | 1 | 3 | 1 | 21 | 274.841 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.79 | 3.61 | -5.34 | 0 | 3 | 0 | 19 | 273.833 | 4 | ↓ |