In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 24 | Yes |
Popular Name: (2S)-4-ethyl-2-[(2-methyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanylmethyl]morpholine (2S)-4-ethyl-2-[(2-methyl-[1,2,4…
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) | 2.42 | 7.56 | -11.53 | 0 | 6 | 0 | 56 | 343.456 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 9.82 | -46.61 | 1 | 6 | 1 | 57 | 344.464 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.