In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 16 | Yes |
Popular Name: N-[[(2R,4R)-4-methoxypyrrolidin-2-yl]methyl]-1-(2-methylthiazol-5-yl)methanamine N-[[(2R,4R)-4-methoxypyrrolidin-…
None
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) | 0.26 | 1.43 | -40.48 | 3 | 4 | 1 | 51 | 242.368 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 1.45 | -44.7 | 3 | 4 | 1 | 51 | 242.368 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.26 | 0.1 | -5.58 | 2 | 4 | 0 | 46 | 241.36 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 2.79 | -127.66 | 4 | 4 | 2 | 55 | 243.376 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.