In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | No |
Popular Name: (3S)-N-[[2-(ethylaminomethyl)thiazol-4-yl]methyl]-N-methyl-1,1-dioxo-thiolan-3-amine (3S)-N-[[2-(ethylaminomethyl)thi…
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) | 0.10 | 0.33 | -48.41 | 2 | 5 | 1 | 67 | 304.461 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.10 | 2.8 | -111.48 | 3 | 5 | 2 | 68 | 305.469 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.