| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2004 | 18 | Yes |
Popular Name: Cyclopentanecarboxamide, N-[2-methyl-6-(1-methylethyl)phenyl]- (9CI) Cyclopentanecarboxamide, N-[2-me…
Find On: PubMed — Wikipedia — Google
CAS Number: 546079-70-3
| 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) | 3.35 | 9.17 | -7.27 | 1 | 2 | 0 | 29 | 245.366 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.48 | 7.66 | -29.86 | 2 | 2 | 1 | 34 | 246.374 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
