In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: 2-hydroxy-N-methyl-N-(pyridin-4-ylmethyl)benzamide 2-hydroxy-N-methyl-N-(pyridin-4-…
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CAS Numbers: 1155058-96-0 , 917377-75-4
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) | 1.50 | 4.68 | -13.51 | 1 | 4 | 0 | 53 | 242.278 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 5.6 | -57.98 | 0 | 4 | -1 | 56 | 241.27 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 5.14 | -39.78 | 2 | 4 | 1 | 55 | 243.286 | 3 | ↓ |