In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 26 | Yes |
Popular Name: 2-(2-furyl)-5-[(S)-morpholino(2-thienyl)methyl]thiazolo[2,3-e][1,2,4]triazol-6-ol 2-(2-furyl)-5-[(S)-morpholino(2-…
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) | 3.23 | 4.4 | -53.19 | 0 | 7 | -1 | 79 | 387.466 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 3.69 | -9.67 | 1 | 7 | 0 | 76 | 388.474 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 5.93 | -38.41 | 2 | 7 | 1 | 77 | 389.482 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 6.64 | -40.3 | 1 | 7 | 0 | 80 | 388.474 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.