| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 22 | Yes |
Popular Name: 1-Phenyl-1-[4-(1-piperidinyl)phenyl]-2-propyn-1-ol, 97% 1-Phenyl-1-[4-(1-piperidinyl)phe…
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CAS Number: 214746-69-7
| 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) | 3.48 | 9.18 | -6.85 | 1 | 2 | 0 | 23 | 291.394 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.48 | 9.84 | -34.63 | 2 | 2 | 1 | 25 | 292.402 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 142-144? | Alfa-Aesar |
| Melting_Point | 142-144° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.