In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 13 | Yes |
Popular Name: N-[[(2S)-pyrrolidin-2-yl]methyl]-1-thiazol-2-yl-methanamine N-[[(2S)-pyrrolidin-2-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) | 0.33 | 1.64 | -34.98 | 3 | 3 | 1 | 42 | 198.315 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.33 | 2.9 | -117.88 | 4 | 3 | 2 | 46 | 199.323 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.