| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 19 | No |
Popular Name: N4,N4-diethyl-N1-[(4S)-4-ethyl-4,5-dihydrothiazol-2-yl]benzene-1,4-diamine N4,N4-diethyl-N1-[(4S)-4-ethyl-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) | 3.81 | 8.85 | -24.99 | 2 | 3 | 1 | 29 | 278.445 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.81 | 8.01 | -4.84 | 1 | 3 | 0 | 28 | 277.437 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 8.94 | -25.56 | 3 | 3 | 0 | 30 | 279.453 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.81 | 8.55 | -24.89 | 2 | 3 | 0 | 29 | 278.445 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
