In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: (7R)-N2-ethyl-N2-(4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,7-diamine (7R)-N2-ethyl-N2-(4-fluorophenyl…
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) | 1.88 | 7.62 | -44.78 | 3 | 3 | 1 | 44 | 292.403 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 7.29 | -6.04 | 2 | 3 | 0 | 42 | 291.395 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.