In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 20 | No |
Popular Name: 1-[5-(2,5-dichlorophenyl)-2-furyl]-N-[(3S)-3H-1,2,4-triazol-3-yl]methanimine 1-[5-(2,5-dichlorophenyl)-2-fury…
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) | 3.78 | 4.23 | -12.03 | 0 | 5 | 0 | 63 | 307.14 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.78 | 5.25 | -37.01 | 1 | 5 | 1 | 64 | 308.148 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.78 | 5.31 | -41.21 | 1 | 5 | 1 | 64 | 308.148 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.