In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 21 | Yes |
Popular Name: (2'S,9S)-2'-phenylspiro[5,6,7,8-tetrahydrobenzo[7]annulene-9,3'-pyrrolidine] (2'S,9S)-2'-phenylspiro[5,6,7,8-…
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) | 4.76 | 10.14 | -42.1 | 2 | 1 | 1 | 17 | 278.419 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.76 | 8.75 | -2.96 | 1 | 1 | 0 | 12 | 277.411 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.