In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 25 | Yes |
Popular Name: 3-[[4-methoxy-3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3,8-diazaspiro[4.5]decane 3-[[4-methoxy-3-(1,2,4-triazol-1…
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) | 0.88 | 10.39 | -101.69 | 3 | 6 | 2 | 61 | 343.475 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 7.9 | -48.53 | 2 | 6 | 1 | 60 | 342.467 | 5 | ↓ |