| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 18 | Yes |
Popular Name: (4S)-N-[(1-methyltriazol-4-yl)methyl]thiochroman-4-amine (4S)-N-[(1-methyltriazol-4-yl)me…
| 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) | 0.85 | 6.13 | -48.3 | 2 | 4 | 1 | 47 | 261.374 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.85 | 5.3 | -12.06 | 1 | 4 | 0 | 43 | 260.366 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
