| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: (3S)-3-(aminomethyl)-N-methyl-N-[(4-methylthiazol-5-yl)methyl]-1,1-dioxo-thian-3-amine (3S)-3-(aminomethyl)-N-methyl-N-…
| 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) | -0.20 | -0.63 | -55.69 | 3 | 5 | 1 | 78 | 304.461 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.20 | -1.49 | -13.67 | 2 | 5 | 0 | 76 | 303.453 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
