In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 20 | Yes |
Popular Name: (2S)-1-morpholino-2-[[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]amino]propan-1-one (2S)-1-morpholino-2-[[(4R)-4,5,6…
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) | 0.71 | 4.89 | -38.58 | 2 | 4 | 1 | 46 | 295.428 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.71 | 4.4 | -8.3 | 1 | 4 | 0 | 42 | 294.42 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.