In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 18 | Yes |
Popular Name: 1-[2-[[(4S)-4,5,6,7-tetrahydrobenzothiophen-4-yl]amino]ethyl]imidazolidin-2-one 1-[2-[[(4S)-4,5,6,7-tetrahydrobe…
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) | 0.38 | 4.62 | -45.88 | 3 | 4 | 1 | 49 | 266.39 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 3.43 | -11.2 | 2 | 4 | 0 | 44 | 265.382 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.