In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 18 | Yes |
Popular Name: (6S)-2-ethyl-N-(2-thienylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (6S)-2-ethyl-N-(2-thienylmethyl)…
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) | 1.61 | 6.99 | -53.19 | 2 | 4 | 1 | 47 | 263.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 5.84 | -8.35 | 1 | 4 | 0 | 43 | 262.382 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.