In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 19 | No |
Popular Name: N-[3-[4-(chloromethyl)thiazol-2-yl]propyl]-N',N'-dimethyl-N-propyl-ethane-1,2-diamine N-[3-[4-(chloromethyl)thiazol-2-…
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) | 2.80 | 7.28 | -39.53 | 1 | 3 | 1 | 21 | 304.911 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 9.74 | -113.33 | 2 | 3 | 2 | 22 | 305.919 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 7.58 | -39.32 | 1 | 3 | 1 | 21 | 304.911 | 10 | ↓ |