In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-(1-cyclopropyltetrazol-5-yl)sulfanyl-2-methyl-propanenitrile (2S)-2-amino-3-(1-cyclopropyltet…
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) | 0.23 | 2.03 | -13.08 | 2 | 6 | 0 | 93 | 224.293 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 2.3 | -60.45 | 3 | 6 | 1 | 95 | 225.301 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.