In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 25 | Yes |
Popular Name: 3-(1H-indol-3-yl)-N-(3-phenyl-1,2,4-thiadiazol-5-yl)propanamide 3-(1H-indol-3-yl)-N-(3-phenyl-1,…
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) | 4.22 | 9.24 | -12.73 | 2 | 5 | 0 | 71 | 348.431 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.41 | 7.79 | -45.46 | 1 | 5 | -1 | 77 | 347.423 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.