| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 21 | Yes |
Popular Name: (7S)-N2-(4-fluorophenyl)-N2,5,5-trimethyl-6,7-dihydro-4H-1,3-benzothiazole-2,7-diamine (7S)-N2-(4-fluorophenyl)-N2,5,5-…
| 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) | 2.39 | 7.97 | -50.81 | 3 | 3 | 1 | 44 | 306.43 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 7.63 | -6.43 | 2 | 3 | 0 | 42 | 305.422 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 8 | -96.87 | 4 | 3 | 2 | 45 | 307.438 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
