In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 18 | Yes |
Popular Name: N-methyl-1-[5-methyl-4-[[methyl(thiazol-4-ylmethyl)amino]methyl]-2-furyl]methanamine N-methyl-1-[5-methyl-4-[[methyl(…
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) | 1.27 | 6.31 | -89.85 | 3 | 4 | 2 | 47 | 267.398 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.27 | 4.01 | -40.78 | 2 | 4 | 1 | 46 | 266.39 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.