In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 17 | Yes |
Popular Name: 5-[(1S)-1-aminoethyl]-N-methyl-N-(1-methyl-4-piperidyl)thiazol-2-amine 5-[(1S)-1-aminoethyl]-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) | -0.38 | 5.41 | -87.6 | 4 | 4 | 2 | 48 | 256.419 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.38 | 5.09 | -39.79 | 3 | 4 | 1 | 47 | 255.411 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.