In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 21 | Yes |
Popular Name: N-[[(3R)-1-[(4-isopropylphenyl)methyl]-3-piperidyl]methyl]cyclopropanamine N-[[(3R)-1-[(4-isopropylphenyl)m…
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) | 4.18 | 9.38 | -36.98 | 2 | 2 | 1 | 20 | 287.471 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 11.61 | -101.3 | 3 | 2 | 2 | 21 | 288.479 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.