In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 28 | Yes |
Popular Name: 7-methyl-3-(2,7,8-trimethylquinoline-4-carbonyl)-3,7,10-triazaspiro[5.5]undecan-11-one 7-methyl-3-(2,7,8-trimethylquino…
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) | 1.84 | 7.05 | -51.17 | 2 | 6 | 1 | 67 | 381.5 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 4.86 | -12.39 | 1 | 6 | 0 | 66 | 380.492 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.