In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 17 | Yes |
Popular Name: 5-chloro-4-[[(2R)-2-(2-thienyl)pyrrolidin-1-yl]methyl]thiadiazole 5-chloro-4-[[(2R)-2-(2-thienyl)p…
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) | 3.26 | 7.25 | -29.7 | 1 | 3 | 1 | 30 | 286.833 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 4.74 | -5.95 | 0 | 3 | 0 | 29 | 285.825 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.