In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | Yes |
Popular Name: (1S)-2-methyl-N-[3-(1-piperidyl)propyl]-1-(2-thienyl)propan-1-amine (1S)-2-methyl-N-[3-(1-piperidyl)…
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) | 3.91 | 8.98 | -33.68 | 2 | 2 | 1 | 16 | 281.489 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 10.18 | -101.15 | 3 | 2 | 2 | 21 | 282.497 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.