In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: N'-[[2-(diethylamino)thiazol-5-yl]methyl]-N,N-diethyl-ethane-1,2-diamine N'-[[2-(diethylamino)thiazol-5-y…
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) | 2.43 | 7.49 | -35.47 | 2 | 4 | 1 | 33 | 285.481 | 10 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 5.37 | -4.99 | 1 | 4 | 0 | 31 | 284.473 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 7.94 | -72.23 | 3 | 4 | 2 | 34 | 286.489 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 8.82 | -114.09 | 3 | 4 | 2 | 37 | 286.489 | 10 | ↓ |