In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 18 | Yes |
Popular Name: (2R)-1-methoxy-N-[2-[2-(2-thienyl)imidazol-1-yl]ethyl]propan-2-amine (2R)-1-methoxy-N-[2-[2-(2-thieny…
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) | 1.99 | 6.16 | -47.41 | 2 | 4 | 1 | 44 | 266.39 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.99 | 4.95 | -7.64 | 1 | 4 | 0 | 39 | 265.382 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.99 | 6.67 | -92.62 | 3 | 4 | 2 | 45 | 267.398 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.