In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 26 | Yes |
Popular Name: N-propyl-5-[[4-[(5R)-5H-purin-6-yl]piperazin-1-yl]methyl]pyrimidin-2-amine N-propyl-5-[[4-[(5R)-5H-purin-6-…
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) | 0.26 | 7.22 | -12.28 | 1 | 9 | 0 | 94 | 353.434 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.26 | 7.38 | -43 | 2 | 9 | 1 | 95 | 354.442 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.