In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 18 | Yes |
Popular Name: (1S)-N,N-dimethyl-1-[(2S)-pyrrolidin-2-yl]-1-(2,4,5-trimethylphenyl)methanamine (1S)-N,N-dimethyl-1-[(2S)-pyrrol…
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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) | 3.30 | 6.37 | -34.84 | 2 | 2 | 1 | 20 | 247.406 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.30 | 9 | -102.07 | 3 | 2 | 2 | 21 | 248.414 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.