In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 17 | Yes |
Popular Name: (2S)-N-methyl-2-(1-methyltetrazol-5-yl)sulfanyl-2-phenyl-ethanamine (2S)-N-methyl-2-(1-methyltetrazo…
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) | 1.60 | 5.24 | -40.74 | 2 | 5 | 1 | 60 | 250.351 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 3.96 | -8.44 | 1 | 5 | 0 | 56 | 249.343 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.