In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 15 | Yes |
Popular Name: (2S)-N,N',2-trimethyl-N'-[(2-methylthiazol-4-yl)methyl]propane-1,3-diamine (2S)-N,N',2-trimethyl-N'-[(2-met…
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) | 1.16 | 3.77 | -41.88 | 2 | 3 | 1 | 33 | 228.385 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 5.87 | -102.07 | 3 | 3 | 2 | 34 | 229.393 | 6 | ↓ |