In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 21 | Yes |
Popular Name: 2-[[5-[(3S)-3-ethylmorpholin-4-yl]-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[5-[(3S)-3-ethylmorpholin-4-y…
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) | 1.50 | 8.09 | -47.52 | 0 | 7 | -1 | 83 | 313.403 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.