In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 23 | Yes |
Popular Name: 1-[(2S)-2-[(2S)-1-thieno[3,2-d]pyrimidin-4-ylpyrrolidin-2-yl]pyrrolidin-1-yl]propan-1-one 1-[(2S)-2-[(2S)-1-thieno[3,2-d]p…
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) | 2.53 | 9.66 | -17.47 | 0 | 5 | 0 | 49 | 330.457 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 10.12 | -31.89 | 1 | 5 | 1 | 51 | 331.465 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.