In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: N-[(1R)-1-(2-tert-butyl-4-methyl-thiazol-5-yl)ethyl]-N',N'-dimethyl-ethane-1,2-diamine N-[(1R)-1-(2-tert-butyl-4-methyl…
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) | 2.92 | 6.23 | -39.13 | 2 | 3 | 1 | 29 | 270.466 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 3.78 | -4.72 | 1 | 3 | 0 | 28 | 269.458 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 7.43 | -116.17 | 3 | 3 | 2 | 34 | 271.474 | 6 | ↓ |