In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 13 | Yes |
Popular Name: (3R)-1-[(2-methylthiazol-5-yl)methyl]pyrrolidin-3-amine (3R)-1-[(2-methylthiazol-5-yl)me…
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) | -0.38 | 0.51 | -48.55 | 3 | 3 | 1 | 44 | 198.315 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.38 | 0.24 | -4.69 | 2 | 3 | 0 | 42 | 197.307 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.