In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 17 | Yes |
Popular Name: N-[(2-methylthiazol-5-yl)methyl]-1-[(3S)-3-propylpyrrolidin-3-yl]methanamine N-[(2-methylthiazol-5-yl)methyl]…
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) | 1.81 | 4.17 | -43.56 | 3 | 3 | 1 | 42 | 254.423 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.81 | 5.33 | -114.97 | 4 | 3 | 2 | 46 | 255.431 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.