In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 22 | Yes |
Popular Name: 1-(2-methoxyethyl)-4-[(2-phenyltriazol-4-yl)methyl]piperazine 1-(2-methoxyethyl)-4-[(2-phenylt…
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) | 1.05 | 5.62 | -36.86 | 1 | 6 | 1 | 48 | 302.402 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 5.58 | -39.96 | 1 | 6 | 1 | 48 | 302.402 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 3.32 | -9.09 | 0 | 6 | 0 | 46 | 301.394 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.