In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 17 | Yes |
Popular Name: N-(2-methoxyethyl)-N-[[3-(methylaminomethyl)isoxazol-5-yl]methyl]cyclopropanamine N-(2-methoxyethyl)-N-[[3-(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) | 0.61 | 4.8 | -90.9 | 3 | 5 | 2 | 56 | 241.335 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 2.98 | -42.49 | 2 | 5 | 1 | 55 | 240.327 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.