| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 13 | No |
Popular Name: (3R)-N-methyl-N-[[(4S)-thiazolidin-4-yl]methyl]tetrahydrothiophen-3-amine (3R)-N-methyl-N-[[(4S)-thiazolid…
| 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) | 1.13 | 4.8 | -44.17 | 2 | 2 | 1 | 16 | 219.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 3.8 | -40.62 | 2 | 2 | 1 | 20 | 219.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 2.48 | -4.79 | 1 | 2 | 0 | 15 | 218.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
