In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 16 | Yes |
Popular Name: N-methyl-1-[4-[[(2R)-2-methylmorpholin-4-yl]methyl]thiazol-2-yl]methanamine N-methyl-1-[4-[[(2R)-2-methylmor…
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) | 0.41 | 1.36 | -39.9 | 2 | 4 | 1 | 42 | 242.368 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.41 | -0.09 | -4.96 | 1 | 4 | 0 | 37 | 241.36 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.41 | 3.66 | -91.23 | 3 | 4 | 2 | 43 | 243.376 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.