In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | Yes |
Popular Name: (2S)-N1-tert-butyl-N2,3-dimethyl-N2-[(2-methylthiazol-4-yl)methyl]butane-1,2-diamine (2S)-N1-tert-butyl-N2,3-dimethyl…
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) | 2.70 | 5.66 | -30.44 | 2 | 3 | 1 | 33 | 284.493 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 4.46 | -3.82 | 1 | 3 | 0 | 28 | 283.485 | 7 | ↓ |