In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 17 | No |
Popular Name: N-[[4-(thiomorpholinomethyl)thiazol-2-yl]methyl]propan-1-amine N-[[4-(thiomorpholinomethyl)thia…
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) | 1.47 | 4.55 | -39.93 | 2 | 3 | 1 | 33 | 272.463 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 3.19 | -5.62 | 1 | 3 | 0 | 28 | 271.455 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 6.67 | -94.45 | 3 | 3 | 2 | 34 | 273.471 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.