In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 36 | No |
Popular Name: [2-[(4S)-6-amino-5-cyano-3-(3-nitrophenyl)-1,4-dihydropyrano[5,6-d]pyrazol-4-yl]phenyl] [2-[(4S)-6-amino-5-cyano-3-(3-ni…
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) | 2.25 | 5.63 | -18.03 | 3 | 12 | 0 | 172 | 488.46 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.