In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 21 | Yes |
Popular Name: (2-hydroxyphenyl)-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]methanone (2-hydroxyphenyl)-[4-(pyrrolidin…
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) | 2.60 | 7.02 | -43.12 | 2 | 4 | 1 | 45 | 289.399 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 7.84 | -75.07 | 1 | 4 | 0 | 48 | 288.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.