In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 25 | Yes |
Popular Name: (6S)-N-[(2-benzyloxyphenyl)methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6S)-N-[(2-benzyloxyphenyl)methy…
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) | 2.65 | 10.73 | -48.96 | 2 | 5 | 1 | 57 | 335.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 9.54 | -8.82 | 1 | 5 | 0 | 52 | 334.423 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.