In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 17 | Yes |
Popular Name: (2S)-2-methyl-N-[(5-methyl-2-thienyl)methyl]-3-pyrrolidin-1-yl-propan-1-amine (2S)-2-methyl-N-[(5-methyl-2-thi…
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) | 2.80 | 7.78 | -33.08 | 2 | 2 | 1 | 16 | 253.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 9.15 | -101.73 | 3 | 2 | 2 | 21 | 254.443 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.