In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 15 | No |
Popular Name: (5S)-5-methyl-N-[2-(3-pyridyl)ethyl]-4,5-dihydrothiazol-2-amine (5S)-5-methyl-N-[2-(3-pyridyl)et…
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) | 1.33 | 5.15 | -31.87 | 2 | 3 | 1 | 39 | 222.337 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.33 | 5.62 | -77.71 | 3 | 3 | 2 | 40 | 223.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.