In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 28th, 2008 | 18 | No |
Popular Name: (3Z,4S)-3-(2-dimethylaminoethylimino)-4-phenyl-cyclobutane-1,2-dione (3Z,4S)-3-(2-dimethylaminoethyli…
None
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) | 0.55 | 5.52 | -43.61 | 1 | 4 | 0 | 51 | 245.302 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.55 | 3.04 | -6.68 | 0 | 4 | 0 | 50 | 244.294 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.55 | 3 | -6.84 | 0 | 4 | 0 | 50 | 244.294 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 5.48 | -57.01 | 1 | 4 | 0 | 51 | 245.302 | 4 | ↓ |