In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: N-methyl-5-[(1S)-1-(propylamino)ethyl]-N-[[(2S)-tetrahydropyran-2-yl]methyl]thiazol-2-amine N-methyl-5-[(1S)-1-(propylamino)…
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) | 3.21 | 7.69 | -37.08 | 2 | 4 | 1 | 42 | 298.476 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.21 | 6.5 | -4.74 | 1 | 4 | 0 | 37 | 297.468 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.