| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 8th, 2006 | 27 | Yes |
Popular Name: Acetamide, 2-[[3-(cyclopentylmethyl)-2-quinolinyl]thio]-N-(5-methyl-3-isoxazolyl)- (9CI) Acetamide, 2-[[3-(cyclopentylmet…
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CAS Number: 606113-86-4
| 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) | 4.41 | 11.33 | -10.18 | 1 | 5 | 0 | 68 | 381.501 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | 11.57 | -36.16 | 2 | 5 | 1 | 69 | 382.509 | 6 | ↓ |
