In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 18 | Yes |
Popular Name: (2S)-2-(4,5-dimethylthiazol-2-yl)-5-methyl-N-propyl-hexan-2-amine (2S)-2-(4,5-dimethylthiazol-2-yl…
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) | 4.03 | 8 | -35.89 | 2 | 2 | 1 | 29 | 269.478 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.03 | 7.04 | -3.54 | 1 | 2 | 0 | 25 | 268.47 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.03 | 8.54 | -96 | 3 | 2 | 2 | 31 | 270.486 | 7 | ↓ |