In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 16 | No |
Popular Name: (5S)-5-methyl-N-[(1S)-1-methyl-2-morpholino-ethyl]-4,5-dihydrothiazol-2-amine (5S)-5-methyl-N-[(1S)-1-methyl-2…
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) | 0.96 | 2.61 | -27.2 | 2 | 4 | 1 | 38 | 244.384 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 2.62 | -27.21 | 2 | 4 | 1 | 38 | 244.384 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 4.94 | -95.5 | 3 | 4 | 2 | 40 | 245.392 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.96 | 4.91 | -92.18 | 3 | 4 | 2 | 40 | 245.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.