In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 15 | No |
Popular Name: (2S)-N-methyl-N-[(3S)-tetrahydrothiophen-3-yl]piperidine-2-carboxamide (2S)-N-methyl-N-[(3S)-tetrahydro…
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) | 0.99 | 5.05 | -39.73 | 2 | 3 | 1 | 37 | 229.369 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 3.88 | -7.63 | 1 | 3 | 0 | 32 | 228.361 | 2 | ↓ |