| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 17 | No |
Popular Name: N-[(3-nitrophenyl)methyl]tetrahydrothiopyran-4-amine N-[(3-nitrophenyl)methyl]tetrahy…
| 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) | 2.35 | 8.06 | -58.1 | 2 | 4 | 1 | 62 | 253.347 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 6.86 | -8.93 | 1 | 4 | 0 | 58 | 252.339 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
