| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 17 | Yes |
Popular Name: 2-methyl-N-[[4-(pyrrolidin-1-ylmethyl)thiazol-2-yl]methyl]propan-1-amine 2-methyl-N-[[4-(pyrrolidin-1-ylm…
| 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) | 1.73 | 7.05 | -88.94 | 3 | 3 | 2 | 34 | 255.431 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 4.56 | -38.13 | 2 | 3 | 1 | 33 | 254.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 5.83 | -30.97 | 2 | 3 | 1 | 29 | 254.423 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 3.33 | -4.26 | 1 | 3 | 0 | 28 | 253.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
