In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 27 | Yes |
Popular Name: (1,9-dimethyl-1,4,9-triazaspiro[5.5]undecan-4-yl)-[4-(2-methyltetrazol-5-yl)phenyl]methanone (1,9-dimethyl-1,4,9-triazaspiro[…
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) | 0.78 | 5.99 | -41.06 | 1 | 8 | 1 | 72 | 370.481 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.78 | 8.19 | -110.43 | 2 | 8 | 2 | 73 | 371.489 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.