In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 26 | Yes |
Popular Name: 3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(2-furylmethyl)propanamide 3-[4-(1,2-benzothiazol-3-yl)pipe…
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) | 2.52 | 8.57 | -48.7 | 2 | 6 | 1 | 63 | 371.486 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 6.36 | -13.54 | 1 | 6 | 0 | 62 | 370.478 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.