In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 17 | Yes |
Popular Name: N-(2-methoxyethyl)-N-[[2-(methylaminomethyl)thiazol-4-yl]methyl]cyclopropanamine N-(2-methoxyethyl)-N-[[2-(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) | 0.55 | 4.34 | -85.08 | 3 | 4 | 2 | 43 | 257.403 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.55 | 0.8 | -7.43 | 1 | 4 | 0 | 37 | 255.387 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 2.24 | -37.93 | 2 | 4 | 1 | 42 | 256.395 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.