In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 27 | No |
Popular Name: 1-[(2S)-2-(dimethylamino)-2-(p-tolyl)ethyl]-3-(1,3-dioxoisoindolin-5-yl)urea 1-[(2S)-2-(dimethylamino)-2-(p-t…
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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) | 3.00 | 5.33 | -49.12 | 4 | 7 | 1 | 95 | 367.429 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 2.71 | -11.03 | 3 | 7 | 0 | 94 | 366.421 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.