In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 15 | Yes |
Popular Name: 2-(1-tetrahydropyran-4-yltriazol-4-yl)propan-2-amine 2-(1-tetrahydropyran-4-yltriazol…
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) | 0.66 | 1.06 | -50.48 | 3 | 5 | 1 | 68 | 211.289 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 0.81 | -7.31 | 2 | 5 | 0 | 66 | 210.281 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.