In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 25 | Yes |
Popular Name: (7,10-dimethyl-3,7,10-triazaspiro[5.5]undecan-3-yl)-[4-(propylamino)phenyl]methanone (7,10-dimethyl-3,7,10-triazaspir…
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) | 2.02 | 6.56 | -44.7 | 2 | 5 | 1 | 40 | 345.511 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 4.53 | -8.52 | 1 | 5 | 0 | 39 | 344.503 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.