In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 15 | No |
Popular Name: 5-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]-1,3,4-thiadiazole-2-thiol 5-[[(1S)-2-(diethylamino)-1-meth…
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) | 2.14 | 5.9 | -59.8 | 2 | 4 | 0 | 42 | 246.405 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 3.69 | -41.85 | 1 | 4 | -1 | 41 | 245.397 | 6 | ↓ |