In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 12 | Yes |
Popular Name: N,N'-dimethyl-N'-(thiazol-4-ylmethyl)ethane-1,2-diamine N,N'-dimethyl-N'-(thiazol-4-ylme…
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) | 0.70 | 1.02 | -39.12 | 2 | 3 | 1 | 33 | 186.304 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.70 | -0.44 | -5.09 | 1 | 3 | 0 | 28 | 185.296 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.70 | 3.34 | -107.81 | 3 | 3 | 2 | 34 | 187.312 | 5 | ↓ |