In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 22 | No |
Popular Name: 3-[2-[4-[(2S)-2-hydroxy-3,3-dimethyl-butyl]piperazin-1-yl]ethyl]imidazolidine-2,4-dione 3-[2-[4-[(2S)-2-hydroxy-3,3-dime…
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) | 0.16 | 0.99 | -41.03 | 3 | 7 | 1 | 77 | 313.422 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.16 | 1.01 | -39.12 | 3 | 7 | 1 | 77 | 313.422 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.16 | -1.25 | -11.05 | 2 | 7 | 0 | 76 | 312.414 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.