In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 16 | Yes |
Popular Name: 1-[(3R)-3-ethylpyrrolidin-3-yl]-N-methyl-N-(thiazol-4-ylmethyl)methanamine 1-[(3R)-3-ethylpyrrolidin-3-yl]-…
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) | 1.78 | 3.66 | -38.48 | 2 | 3 | 1 | 33 | 240.396 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 5.25 | -100.9 | 3 | 3 | 2 | 34 | 241.404 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.