In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 20 | Yes |
Popular Name: (2S)-4-[4-(methylamino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl]piperazine-2-carboxylic (2S)-4-[4-(methylamino)-6,7-dihy…
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) | -0.75 | 7.56 | -56.61 | 4 | 7 | 1 | 99 | 278.336 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.75 | 7.27 | -37.28 | 3 | 7 | 0 | 98 | 277.328 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.