In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2010 | 18 | Yes |
Popular Name: N-methyl-N-[[(2S)-4-methyl-2H-imidazol-2-yl]methyl]-3-(4-methylthiazol-5-yl)propan-1-amine N-methyl-N-[[(2S)-4-methyl-2H-im…
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) | 1.82 | 4.12 | -38.34 | 1 | 4 | 1 | 42 | 265.406 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 1.99 | -8.4 | 0 | 4 | 0 | 41 | 264.398 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.