In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 18 | Yes |
Popular Name: Butanamide, N-[5-[(2-methyl-1-oxopropyl)amino]-2-pyridinyl]- (9CI) Butanamide, N-[5-[(2-methyl-1-ox…
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CAS Number: 603083-62-1
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) | 2.13 | 5.03 | -14.71 | 2 | 5 | 0 | 71 | 249.314 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 4.79 | -30.72 | 3 | 5 | 1 | 72 | 250.322 | 5 | ↓ |