In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: (2S)-N-[4-(methanesulfonamido)-3-methyl-phenyl]piperidine-2-carboxamide (2S)-N-[4-(methanesulfonamido)-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) | 1.41 | 2.08 | -46.8 | 4 | 6 | 1 | 92 | 312.415 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 0.84 | -51.34 | 2 | 6 | -1 | 89 | 310.399 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.41 | 2.13 | -62.12 | 3 | 6 | 0 | 94 | 311.407 | 4 | ↓ |