In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 18 | No |
Popular Name: (2-aminothiazol-4-yl)-[(3R)-3-(diethylamino)pyrrolidin-1-yl]methanone (2-aminothiazol-4-yl)-[(3R)-3-(d…
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) | 1.05 | 4.94 | -39.72 | 3 | 5 | 1 | 64 | 269.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 2.76 | -8.48 | 2 | 5 | 0 | 62 | 268.386 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.