In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 20 | Yes |
Popular Name: 1-[(2S)-2-methyl-3-(thieno[3,2-d]pyrimidin-4-ylamino)propyl]pyrrolidin-2-one 1-[(2S)-2-methyl-3-(thieno[3,2-d…
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) | 1.78 | 6.91 | -14.15 | 1 | 5 | 0 | 58 | 290.392 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 7.36 | -34.63 | 2 | 5 | 1 | 59 | 291.4 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.