In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 18 | Yes |
Popular Name: N-[[(3S)-3-methyl-3-piperidyl]methyl]-N-(2-thienylmethyl)propan-2-amine N-[[(3S)-3-methyl-3-piperidyl]me…
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) | 2.77 | 6.68 | -39.32 | 2 | 2 | 1 | 20 | 267.462 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 7.95 | -100.05 | 3 | 2 | 2 | 21 | 268.47 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.